Name: Name:3-(5-Bromo-2-chloropyrimidin-4-yl)-1-(phenylsulfonyl)-1H-indole
Brand: Angene
SKU: AG00HYRF
Rating: 90 (10 reviews)

3-(5-Bromo-2-chloropyrimidin-4-yl)-1-(phenylsulfonyl)-1H-indole

CAS No.:

1624262-44-7

Catalog Number:

AG00HYRF

Molecular Formula:

C18H11BrClN3O2S

Molecular Weight:

448.7208

Catalog Number:

AG00HYRF

Chemical Name:

3-(5-Bromo-2-chloropyrimidin-4-yl)-1-(phenylsulfonyl)-1H-indole

CAS Number:

1624262-44-7

Molecular Formula:

C18H11BrClN3O2S

Molecular Weight:

448.7208

MDL Number:

MFCD16658984

IUPAC Name:

1-(benzenesulfonyl)-3-(5-bromo-2-chloropyrimidin-4-yl)indole

InChI:

InChI=1S/C18H11BrClN3O2S/c19-15-10-21-18(20)22-17(15)14-11-23(16-9-5-4-8-13(14)16)26(24,25)12-6-2-1-3-7-12/h1-11H

InChI Key:

ATOBJZOVMPIWCJ-UHFFFAOYSA-N

SMILES:

Clc1ncc(c(n1)c1cn(c2c1cccc2)S(=O)(=O)c1ccccc1)Br

Complexity:

596

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

446.944g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

448.719g/mol

Monoisotopic Mass:

446.944g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

73.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.8