2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7,7-dimethyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile

Chemical Structure Depiction of
2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7,7-dimethyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Available: 47 mg
Amount:
mg
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Compound characteristics

Compound ID: 8008-4869
Compound Name: 2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7,7-dimethyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Molecular Weight: 544.67
Molecular Formula: C30 H32 N4 O4 S
Smiles: CC1(C)CC2=C(C(C(C#N)=C(N)N2c2c(C#N)c3CCCCc3s2)c2cc(c(c(c2)OC)OC)OC)C(C1)=O
Stereo: RACEMIC MIXTURE
logP: 4.4371
logD: 4.4371
logSw: -4.6491
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 2
Polar surface area: 93.4
InChI Key: RZXBPKUMYOOQJP-VWLOTQADSA-N
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