2-chloro-N-(1,3,4-thiadiazol-2-yl)propanamide

2-chloro-N-(1,3,4-thiadiazol-2-yl)propanamide

CAS: 1019456-17-7

Formula: C5H6ClN3OS

SMILES: CC(Cl)C(=O)NC1=NN=CS1

IUPAC: 2-chloro-N-(1,3,4-thiadiazol-2-yl)propanamide

InChI: InChI=1/C5H6ClN3OS/c1-3(6)4(10)8-5-9-7-2-11-5/h2-3H,1H3,(H,8,9,10)

Composition: C (31.34%), H (3.16%), Cl (18.50%), N (21.93%), O (8.35%), S (16.73%)

Molar Mass: 191.63

Atom Count: 17

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	190.9920107
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	DABZOVVOBDHPTI-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.97
Topological Polar Surface Area	54.88
Polarizability	16.04
Ring Count	1
Rotatable Bond Count	2

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