3-(2-chlorobenzoyl)-1-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]thiourea

3-(2-chlorobenzoyl)-1-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]thiourea

Formula: C24H20ClN3O2S

SMILES: CC1=CC(C)=C2OC(=NC2=C1)C1=C(C)C(NC(=S)NC(=O)C2=CC=CC=C2Cl)=CC=C1

IUPAC: 3-(2-chlorobenzoyl)-1-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]thiourea

InChI: InChI=1S/C24H20ClN3O2S/c1-13-11-14(2)21-20(12-13)26-23(30-21)16-8-6-10-19(15(16)3)27-24(31)28-22(29)17-7-4-5-9-18(17)25/h4-12H,1-3H3,(H2,27,28,29,31)

Composition: C (64.07%), H (4.48%), Cl (7.88%), N (9.34%), O (7.11%), S (7.13%)

Molar Mass: 449.95

Atom Count: 51

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	449.0964758
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	HTNKNNPMFMXNPR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	139.52
Topological Polar Surface Area	67.16
Polarizability	50.12
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H20ClN3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00