Name: Name:4-Pyrimidinamine, 2-chloro-N-[2-[(1-methylethyl)sulfonyl]phenyl]-
Brand: Angene
SKU: AG00IM09
Rating: 90 (10 reviews)

4-Pyrimidinamine, 2-chloro-N-[2-[(1-methylethyl)sulfonyl]phenyl]-

CAS No.:

1197956-18-5

Catalog Number:

AG00IM09

Molecular Formula:

C13H14ClN3O2S

Molecular Weight:

311.7872

Catalog Number:

AG00IM09

Chemical Name:

4-Pyrimidinamine, 2-chloro-N-[2-[(1-methylethyl)sulfonyl]phenyl]-

CAS Number:

1197956-18-5

Molecular Formula:

C13H14ClN3O2S

Molecular Weight:

311.7872

MDL Number:

MFCD28387231

IUPAC Name:

2-chloro-N-(2-propan-2-ylsulfonylphenyl)pyrimidin-4-amine

InChI:

InChI=1S/C13H14ClN3O2S/c1-9(2)20(18,19)11-6-4-3-5-10(11)16-12-7-8-15-13(14)17-12/h3-9H,1-2H3,(H,15,16,17)

InChI Key:

DPZNNEDUNSZUAD-UHFFFAOYSA-N

SMILES:

Clc1nccc(n1)Nc1ccccc1S(=O)(=O)C(C)C

Complexity:

410

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

311.05g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

311.784g/mol

Monoisotopic Mass:

311.05g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6