4-(2-bromobenzoyl)-N-cyclohexyl-1H-pyrrole-2-carboxamide

4-(2-bromobenzoyl)-N-cyclohexyl-1H-pyrrole-2-carboxamide

CAS: 551931-27-2

Formula: C18H19BrN2O2

SMILES: BrC1=C(C=CC=C1)C(=O)C1=CNC(=C1)C(=O)NC1CCCCC1

IUPAC: 4-(2-bromobenzoyl)-N-cyclohexyl-1H-pyrrole-2-carboxamide

InChI: InChI=1S/C18H19BrN2O2/c19-15-9-5-4-8-14(15)17(22)12-10-16(20-11-12)18(23)21-13-6-2-1-3-7-13/h4-5,8-11,13,20H,1-3,6-7H2,(H,21,23)

Composition: C (57.61%), H (5.10%), Br (21.29%), N (7.47%), O (8.53%)

Molar Mass: 375.266

Atom Count: 42

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	374.062991
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	SJZZYFXKUGJQAP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.88
Topological Polar Surface Area	61.96
Polarizability	35.6
Ring Count	3
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	551931-27-2		$51.35-$524.40$51.35$63.37$86.31$524.40