AC1NTWZ4

5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4-(4-methoxyphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one

Also Known As: NCGC00067493-02|AS-871/43360146|SR-01000612973-3|5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one|(3E)-5-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-methoxyphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one|(3Z)-5-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-methoxyphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one|5-(3,4-dimethoxyphenethyl)-3-(2-hydroxyphenyl)-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one|5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4-(4-methoxyphenyl)-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one|5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one|5-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-methoxyphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one

Molecular Formula	C28H27N3O5
Molecular Weight	485.19507 g/mol
LogP	4.5
Topological Polar Surface Area	96.9 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	485.19507
Monoisotopic Mass	485.19507
Heavy Atoms	36
Complexity	732.0

Chemical Identifiers

CAS Number	879934-93-7
SMILES	COC1=CC=C(C=C1)C2C3=C(C(=O)N2CCC4=CC(=C(C=C4)OC)OC)NN=C3C5=CC=CC=C5O
InChIKey	VAGMOVAMBTYREN-UHFFFAOYSA-N