(R) -P7C3-Ome 2mg

CAT: 0628-A12937-2Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0628-A12937-2Size:2 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1235481-43-2

Chemical Information

(R)-1-(3,6-dibromo-9H-carbazol-9-yl)-3-((3-methoxyphenyl)amino)propan-2-ol

CAS Number	1235481-43-2
PubChem CID	1100216
IUPAC Name	(2R)-1-(3,6-dibromocarbazol-9-yl)-3-(3-methoxyanilino)propan-2-ol
Molecular Formula	C22H20Br2N2O2
Molecular Weight	504.2
XLogP	5.7
Topological Polar Surface Area	46.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Heavy Atom Count	28
Formal Charge	0
Complexity	485

SMILES

COC1=CC=CC(=C1)NC[C@H](CN2C3=C(C=C(C=C3)Br)C4=C2C=CC(=C4)Br)O

InChI

InChI=1S/C22H20Br2N2O2/c1-28-18-4-2-3-16(11-18)25-12-17(27)13-26-21-7-5-14(23)9-19(21)20-10-15(24)6-8-22(20)26/h2-11,17,25,27H,12-13H2,1H3/t17-/m1/s1

InChIKey

LEICNUMXFWNCSJ-QGZVFWFLSA-N

Chemical Structure

2D Structure

CAS: 1235481-43-2

CID: 1100216

Formula: C22H20Br2N2O2

MW: 504.2

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	504.2
XLogP3	5.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	503.98710
Monoisotopic Mass	501.98915
Topological Polar Surface Area	46.4 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	485
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes