Products for Research Use Only
RegisterLogin

Maraviroc N-Boc Impurity

CAT: 1596-AR-M05380-01Size: 50 UnitsDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1596-AR-M05380-01Size:50 Units
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
376348-70-8
Synonyms
Tert-butyl ((S) -3- ((1R,3R,5S) -3- (3-isopropyl-5-methyl-4H-1,2,4-triazol-4-yl) -8-azabicyclo[3.2.1]octan-8-yl) -1-phenylpropyl) carbamate
Molecular Formula
C27H41N5O2
Molecular Weight
467.7
API Name
Maraviroc

Chemical Information

N-Boc-(1S)-3-[3-(3-isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-exo-8-azabicyclo[3.2.1]oct-8-yl]-1-phenyl-1-propanamine
CAS Number376348-70-8
PubChem CID46780873
IUPAC Nametert-butyl N-[(1S)-3-[3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octan-8-yl]-1-phenylpropyl]carbamate
Molecular FormulaC27H41N5O2
Molecular Weight467.6
XLogP4.7
Topological Polar Surface Area72.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count34
Formal Charge0
Complexity660
SMILES
CC1=NN=C(N1C2CC3CCC(C2)N3CC[C@@H](C4=CC=CC=C4)NC(=O)OC(C)(C)C)C(C)C
InChI
InChI=1S/C27H41N5O2/c1-18(2)25-30-29-19(3)32(25)23-16-21-12-13-22(17-23)31(21)15-14-24(20-10-8-7-9-11-20)28-26(33)34-27(4,5)6/h7-11,18,21-24H,12-17H2,1-6H3,(H,28,33)/t21?,22?,23?,24-/m0/s1
InChIKey
RFEKTEIXVDWMKV-GVWQBGCGSA-N
Chemical Structure
2D Structure
2D structure of N-Boc-(1S)-3-[3-(3-isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-exo-8-azabicyclo[3.2.1]oct-8-yl]-1-phenyl-1-propanamine
CAS: 376348-70-8
CID: 46780873
Formula: C27H41N5O2
MW: 467.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight467.6
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass467.32602557
Monoisotopic Mass467.32602557
Topological Polar Surface Area72.3 Ų
Heavy Atom Count34
Formal Charge0
Complexity660
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
AR-M05378-01Maraviroc N-Benzyl Impurity
AR-M03889-01Maraviroc Impurity 15
AR-M03887-01Maraviroc Impurity 13
AR-M03880-01Maraviroc Impurity 6
AR-M03885-01Maraviroc Impurity 11
AR-M03886-01Maraviroc Impurity 12
AR-M03896-01Maraviroc Amide Impurity
AR-M05383-01Maraviroc Impurity 20
AR-M03888-01Maraviroc Impurity 14
AR-M03894-01Maraviroc Impurity 3

Alternative Products

CatalogName
CS-EO-02674N-Nitroso Maraviroc Impurity
sc-489630N-Formyl Maraviroc
TRC-I449110-50MGIsavuconazonium N-Boc Impurity
sc-489631N-Formyl Maraviroc-d6
RM-S072010-01(S) -Sitagliptin N-Boc-Acid Impurity
CS-O-15968Boc Velpatasvir Keto Impurity
MBS6116286-01N-Des-(4,4-difluorocyclohexanecarboxy)-N-carbobenzyloxy-3-hydroxymethyl Maraviroc
MBS6107645-014-Benzyloxyphenyl N-Des1-(4,4-difluorocyclohexanecarbonyl) Maraviroc
0037844-Benzyloxyphenyl N-Des1- (4,4-difluorocyclohexanecarbonyl) Maraviroc
sc-500213N-Des- (4,4-difluorocyclohexanecarboxy) -N-carbobenzyloxy-3-hydroxymethyl Maraviroc

Popular Products