8-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-1-(4-methoxyphenyl)-3-phenyl-4-(thiophen-3-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one

Chemical Structure Depiction of
8-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-1-(4-methoxyphenyl)-3-phenyl-4-(thiophen-3-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Available: 17 mg
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mg
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Compound characteristics

Compound ID: V027-7643
Compound Name: 8-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-1-(4-methoxyphenyl)-3-phenyl-4-(thiophen-3-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Molecular Weight: 601.75
Molecular Formula: C31 H31 N5 O4 S2
Salt: not_available
Smiles: CC(N1CCN(CC1)C(CN1C(CSC(c2ccsc2)c2c(c3ccccc3)nn(c3ccc(cc3)OC)c12)=O)=O)=O
Stereo: RACEMIC MIXTURE
logP: 3.7837
logD: 3.7837
logSw: -3.9083
Hydrogen bond acceptors count: 9
Polar surface area: 72.175
InChI Key: PHDWNOGEUTUWPF-PMERELPUSA-N
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