4-(2,4-dichlorobenzoyl)-N-(2-phenylethyl)-1H-pyrrole-2-carboxamide

4-(2,4-dichlorobenzoyl)-N-(2-phenylethyl)-1H-pyrrole-2-carboxamide

CAS: 439109-69-0

Formula: C20H16Cl2N2O2

SMILES: ClC1=CC(Cl)=C(C=C1)C(=O)C1=CNC(=C1)C(=O)NCCC1=CC=CC=C1

IUPAC: 4-(2,4-dichlorobenzoyl)-N-(2-phenylethyl)-1H-pyrrole-2-carboxamide

InChI: InChI=1S/C20H16Cl2N2O2/c21-15-6-7-16(17(22)11-15)19(25)14-10-18(24-12-14)20(26)23-9-8-13-4-2-1-3-5-13/h1-7,10-12,24H,8-9H2,(H,23,26)

Composition: C (62.03%), H (4.16%), Cl (18.31%), N (7.23%), O (8.26%)

Molar Mass: 387.26

Atom Count: 42

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	386.0588832
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	XFPFHTYPNNODDJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	104.22
Topological Polar Surface Area	61.96
Polarizability	39.57
Ring Count	3
Rotatable Bond Count	6

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	439109-69-0		$51.35-$524.40$51.35$63.37$86.31$524.40