(2E)-3-(2-hydroxyphenyl)-2-(5-methyl-1H-1,3-benzodiazol-2-yl)prop-2-enenitrile

(2E)-3-(2-hydroxyphenyl)-2-(5-methyl-1H-1,3-benzodiazol-2-yl)prop-2-enenitrile

Formula: C17H13N3O

SMILES: CC1=CC=C2NC(=NC2=C1)C(=CC1=CC=CC=C1O)C#N

IUPAC: (2E)-3-(2-hydroxyphenyl)-2-(5-methyl-1H-1,3-benzodiazol-2-yl)prop-2-enenitrile

InChI: InChI=1S/C17H13N3O/c1-11-6-7-14-15(8-11)20-17(19-14)13(10-18)9-12-4-2-3-5-16(12)21/h2-9,21H,1H3,(H,19,20)/b13-9+

Composition: C (74.17%), H (4.76%), N (15.26%), O (5.81%)

Molar Mass: 275.311

Atom Count: 34

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	275.105862051
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	XONBKNSFGIRJIL-UKTHLTGXSA-N
Lipinski's Rule of Five	1
Molar Refractivity	81.9
Topological Polar Surface Area	72.7
Polarizability	31.75
Ring Count	3
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H13N3O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00