(9-methyl-3,4,5,6-tetrahydroazepino[4,3-b]indol-2(1H)-yl)(phenyl)methanone
Chemical Structure Depiction of
(9-methyl-3,4,5,6-tetrahydroazepino[4,3-b]indol-2(1H)-yl)(phenyl)methanone
(9-methyl-3,4,5,6-tetrahydroazepino[4,3-b]indol-2(1H)-yl)(phenyl)methanone
Compound characteristics
| Compound ID: | H025-0015 |
| Compound Name: | (9-methyl-3,4,5,6-tetrahydroazepino[4,3-b]indol-2(1H)-yl)(phenyl)methanone |
| Molecular Weight: | 304.39 |
| Molecular Formula: | C20 H20 N2 O |
| Smiles: | Cc1ccc2c(c1)c1CN(CCCc1[nH]2)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1279 |
| logD: | 3.1279 |
| logSw: | -3.3451 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.7295 |
| InChI Key: | YILRJUZZZHZTTN-UHFFFAOYSA-N |