3-benzamido-N-cyclohexylthiophene-2-carboxamide

3-benzamido-N-cyclohexylthiophene-2-carboxamide

CAS: 439120-49-7

Formula: C18H20N2O2S

SMILES: O=C(NC1CCCCC1)C1=C(NC(=O)C2=CC=CC=C2)C=CS1

IUPAC: 3-benzamido-N-cyclohexylthiophene-2-carboxamide

InChI: InChI=1S/C18H20N2O2S/c21-17(13-7-3-1-4-8-13)20-15-11-12-23-16(15)18(22)19-14-9-5-2-6-10-14/h1,3-4,7-8,11-12,14H,2,5-6,9-10H2,(H,19,22)(H,20,21)

Composition: C (65.83%), H (6.14%), N (8.53%), O (9.74%), S (9.76%)

Molar Mass: 328.43

Atom Count: 43

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	328.124549066
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	MHUBSKTURHELAU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.47
Topological Polar Surface Area	58.2
Polarizability	34.76
Ring Count	3
Rotatable Bond Count	4

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90%	<2 Days	439120-49-7		$51.35-$86.31$51.35$63.37$86.31