1-{[1,1'-biphenyl]-4-carbonyl}-3-[2-(4-methoxyphenyl)-6-methyl-1,2,3-benzotriazol-5-yl]thiourea

1-{[1,1'-biphenyl]-4-carbonyl}-3-[2-(4-methoxyphenyl)-6-methyl-1,2,3-benzotriazol-5-yl]thiourea

Formula: C28H23N5O2S

SMILES: COC1=CC=C(C=C1)N1N=C2C=C(C)C(NC(=S)NC(=O)C3=CC=C(C=C3)C3=CC=CC=C3)=CC2=N1

IUPAC: 1-{[1,1'-biphenyl]-4-carbonyl}-3-[2-(4-methoxyphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]thiourea

InChI: InChI=1S/C28H23N5O2S/c1-18-16-25-26(32-33(31-25)22-12-14-23(35-2)15-13-22)17-24(18)29-28(36)30-27(34)21-10-8-20(9-11-21)19-6-4-3-5-7-19/h3-17H,1-2H3,(H2,29,30,34,36)

Composition: C (68.14%), H (4.70%), N (14.19%), O (6.48%), S (6.50%)

Molar Mass: 493.59

Atom Count: 59

Heavy Atom Count: 36

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	493.157246175
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	DJQUDJBCBOHYMM-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	157.78
Topological Polar Surface Area	81.07
Polarizability	58.19
Ring Count	5
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H23N5O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00