2-(4-chlorophenyl)-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]cyclopropane-1-carboxamide

2-(4-chlorophenyl)-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]cyclopropane-1-carboxamide

Formula: C17H20ClN3OS

SMILES: CC(C)(C)CC1=NN=C(NC(=O)C2CC2C2=CC=C(Cl)C=C2)S1

IUPAC: 2-(4-chlorophenyl)-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]cyclopropane-1-carboxamide

InChI: InChI=1/C17H20ClN3OS/c1-17(2,3)9-14-20-21-16(23-14)19-15(22)13-8-12(13)10-4-6-11(18)7-5-10/h4-7,12-13H,8-9H2,1-3H3,(H,19,21,22)

Composition: C (58.36%), H (5.76%), Cl (10.13%), N (12.01%), O (4.57%), S (9.16%)

Molar Mass: 349.88

Atom Count: 43

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	349.1015612
Formal Charge	0
FSP3	0.47
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	UROWBTAOEQYJAP-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	95.27
Topological Polar Surface Area	54.88
Polarizability	35.7
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H20ClN3OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00