N-Hydroxy tipranavir

CAT: 0926-RVB51006-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0926-RVB51006-02Size:10 mg

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CAS Number

1141510-06-6

Smiles

CCCC1 (CC (=C (C (=O) O1) C (CC) C2=CC (=CC=C2) N (O) S (=O) (=O) C3=NC=C (C=C3) C (F) (F) F) O) CCC4=CC=CC=C4

Molecular Formula

C31H33F3N2O6S

Molecular Weight

618.7 g/mol

Controlled

Chemical Information

N-Hydroxy Tipranavir

CAS Number	1141510-06-6
PubChem CID	71749379
IUPAC Name	N-hydroxy-N-[3-[(1R)-1-[(2R)-4-hydroxy-6-oxo-2-(2-phenylethyl)-2-propyl-3H-pyran-5-yl]propyl]phenyl]-5-(trifluoromethyl)pyridine-2-sulfonamide
Molecular Formula	C31H33F3N2O6S
Molecular Weight	618.7
XLogP	6.7
Topological Polar Surface Area	125
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	11
Heavy Atom Count	43
Formal Charge	0
Complexity	1090

SMILES

CCC[C@]1(CC(=C(C(=O)O1)[C@H](CC)C2=CC(=CC=C2)N(O)S(=O)(=O)C3=NC=C(C=C3)C(F)(F)F)O)CCC4=CC=CC=C4

InChI

InChI=1S/C31H33F3N2O6S/c1-3-16-30(17-15-21-9-6-5-7-10-21)19-26(37)28(29(38)42-30)25(4-2)22-11-8-12-24(18-22)36(39)43(40,41)27-14-13-23(20-35-27)31(32,33)34/h5-14,18,20,25,37,39H,3-4,15-17,19H2,1-2H3/t25-,30-/m1/s1

InChIKey

YEVFABAGWJZFRK-FYBSXPHGSA-N

Chemical Structure

2D Structure

CAS: 1141510-06-6

CID: 71749379

Formula: C31H33F3N2O6S

MW: 618.7

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	618.7
XLogP3	6.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	11
Exact Mass	618.20114244
Monoisotopic Mass	618.20114244
Topological Polar Surface Area	125 Å²
Heavy Atom Count	43
Formal Charge	0
Complexity	1090
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
sc-219160	N-Hydroxy Tipranavir
sc-219161	N-Hydroxy Tipranavir-d5
MBS6024689-01	Tipranavir (N-[3-[(1R)-1-[(6R)-5,6-Dihydro-4-hydroxy-2-oxo-6-(2-phenylethyl)-6-propyl-2H-pyran-3-yl]propyl]phenyl]-5-(trifluoromethyl)-2-pyridinesulfonamide, PNU-140690, Aptivus,)
MBS6021677-01	Tipranavir-d4 (N-[3-[(1R)-1-[(6R)-5,6-Dihydro-4-hydroxy-2-oxo-6-(2-phenylethyl)-6-propyl-2H-pyran-3-yl]propyl]phenyl]-5-(trifluoromethyl)-2-pyridinesulfonamide-d4, PNU-140690-d4, Aptivus-d4,)
T5482-05	Tipranavir-d4 (N-[3-[ (1R) -1-[ (6R) -5,6-Dihydro-4-hydroxy-2-oxo-6- (2-phenylethyl) -6-propyl-2H-pyran-3-yl]propyl]phenyl]-5- (trifluoromethyl) -2-pyridinesulfonamide-d4, _x000B_PNU-140690-d4, Aptivus-d4, _x000B_)
sc-220260	Tipranavir
HY-15148S1-01	Tipranavir-d7
A15262-100	Tipranavir 100mg
sc-220261	Tipranavir-d4
A15262-25	Tipranavir 25mg

N-Hydroxy tipranavir

Chemical Information

Related Products

Alternative Products

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