N-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]-4-(heptyloxy)benzamide

N-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]-4-(heptyloxy)benzamide

Formula: C27H27ClN2O3

SMILES: CCCCCCCOC1=CC=C(C=C1)C(=O)NC1=CC=C2OC(=NC2=C1)C1=CC=C(Cl)C=C1

IUPAC: N-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]-4-(heptyloxy)benzamide

InChI: InChI=1S/C27H27ClN2O3/c1-2-3-4-5-6-17-32-23-14-9-19(10-15-23)26(31)29-22-13-16-25-24(18-22)30-27(33-25)20-7-11-21(28)12-8-20/h7-16,18H,2-6,17H2,1H3,(H,29,31)

Composition: C (70.05%), H (5.88%), Cl (7.66%), N (6.05%), O (10.37%)

Molar Mass: 462.97

Atom Count: 60

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	462.1710204
Formal Charge	0
FSP3	0.26
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	KUVLSJXXACNDIL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	142.3
Topological Polar Surface Area	64.36
Polarizability	52.15
Ring Count	4
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C27H27ClN2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00