2-amino-4-(9-ethyl-9H-carbazol-3-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(9-ethyl-9H-carbazol-3-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-4-(9-ethyl-9H-carbazol-3-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
Compound ID: | 3565-0578 |
Compound Name: | 2-amino-4-(9-ethyl-9H-carbazol-3-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
Molecular Weight: | 411.5 |
Molecular Formula: | C26 H25 N3 O2 |
Smiles: | CCn1c2ccccc2c2cc(ccc12)C1C(C#N)=C(N)OC2CC(C)(C)CC(C1=2)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.6362 |
logD: | 4.6362 |
logSw: | -4.6915 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 60.302 |
InChI Key: | SGHQQMUDNRLWQA-HSZRJFAPSA-N |