2-amino-4-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-4H-benzo[h]chromene-3-carbonitrile

2-amino-4-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-4H-benzo[h]chromene-3-carbonitrile

Formula: C24H18N2O3

SMILES: COC1=CC(=CC=C1OCC#C)C1C2=C(OC(N)=C1C#N)C1=CC=CC=C1C=C2

IUPAC: 2-amino-4-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-4H-benzo[h]chromene-3-carbonitrile

InChI: InChI=1/C24H18N2O3/c1-3-12-28-20-11-9-16(13-21(20)27-2)22-18-10-8-15-6-4-5-7-17(15)23(18)29-24(26)19(22)14-25/h1,4-11,13,22H,12,26H2,2H3

Composition: C (75.38%), H (4.74%), N (7.33%), O (12.55%)

Molar Mass: 382.419

Atom Count: 47

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	382.131742448
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	DIPBEFPDSOVYHY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	120.04
Topological Polar Surface Area	77.5
Polarizability	43.1
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H18N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00