Name: Name:5-(chloromethyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Brand: Angene
SKU: AG019PH9
Rating: 90 (10 reviews)

5-(chloromethyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

CAS No.:

113940-14-0

Catalog Number:

AG019PH9

Molecular Formula:

C11H10ClN3OS

Molecular Weight:

267.7346

Catalog Number:

AG019PH9

Chemical Name:

5-(chloromethyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

CAS Number:

113940-14-0

Molecular Formula:

C11H10ClN3OS

Molecular Weight:

267.7346

MDL Number:

MFCD09383891

IUPAC Name:

5-(chloromethyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

InChI:

InChI=1S/C11H10ClN3OS/c1-7-2-4-8(5-3-7)13-10(16)11-15-14-9(6-12)17-11/h2-5H,6H2,1H3,(H,13,16)

InChI Key:

ILVZAUZSRSHHSM-UHFFFAOYSA-N

SMILES:

ClCc1nnc(s1)C(=O)Nc1ccc(cc1)C

Complexity:

271

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

267.023g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

267.731g/mol

Monoisotopic Mass:

267.023g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3