N-(3-phenylpropyl)-N-(pyridin-4-ylmethyl)-2,3-dihydro-1-benzofuran-5-carboxamide

Update Time: 2025-04-25 17:03:18

	Common Name	N-(3-phenylpropyl)-N-(pyridin-4-ylmethyl)-2,3-dihydro-1-benzofuran-5-carboxamide	English Name	N-(3-phenylpropyl)-N-(pyridin-4-ylmethyl)-2,3-dihydro-1-benzofuran-5-carboxamide
	CAS NO.	N/A	Molecular Weight	372.5
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₂₄H₂₄N₂O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A
	Symbol	N/A	Signal Word	N/A

Properties

English Name	N-(3-phenylpropyl)-N-(pyridin-4-ylmethyl)-2,3-dihydro-1-benzofuran-5-carboxamide

Molecular Formula	C24H24N2O2
Molecular Weight	372.5
Exact Mass	372.183778013
LogP	4.10
Standard SMILES	O=C(c1ccc2c(c1)CCO2)N(CCCc1ccccc1)Cc1ccncc1
Canonical SMILES	C1COC2=C1C=C(C=C2)C(=O)N(CCCC3=CC=CC=C3)CC4=CC=NC=C4
Isomeric SMILES	C1COC2=C1C=C(C=C2)C(=O)N(CCCC3=CC=CC=C3)CC4=CC=NC=C4
Standard InChI Identifier	InChI=1S/C24H24N2O2/c27-24(22-8-9-23-21(17-22)12-16-28-23)26(18-20-10-13-25-14-11-20)15-4-7-19-5-2-1-3-6-19/h1-3,5-6,8-11,13-14,17H,4,7,12,15-16,18H2
Standard InChI Key	TZCDBLQXNARLDG-UHFFFAOYSA-N
Compound Complexity	485.00
computational chemistry	Hydrogen Bond Acceptor Count：3 Hydrogen Bond Donor Count：0 Rotatable Bond Count：7 Heavy Atom Count：28 Total Chiral Atom Count：0 Defined Chiral Atom Count：0 Undefined Chiral Atom Count：0 Total Chiral Bond Count：0 Defined Chiral Bond Count：0 Undefined Chiral Bond Count：0 Isotope Atom Count：0 Covalent Unit Count：1 Tautomer Count：-1 Monoisotopic Mass：372.183778013