2-(4-chlorophenoxy)-1-(1-{4-[3-(dimethylamino)propoxy]phenyl}-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-1-(1-{4-[3-(dimethylamino)propoxy]phenyl}-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)ethan-1-one
2-(4-chlorophenoxy)-1-(1-{4-[3-(dimethylamino)propoxy]phenyl}-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | V014-8637 |
| Compound Name: | 2-(4-chlorophenoxy)-1-(1-{4-[3-(dimethylamino)propoxy]phenyl}-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)ethan-1-one |
| Molecular Weight: | 548.08 |
| Molecular Formula: | C31 H34 Cl N3 O4 |
| Salt: | not_available |
| Smiles: | CN(C)CCCOc1ccc(cc1)C1c2c(CCN1C(COc1ccc(cc1)[Cl])=O)c1cc(ccc1[nH]2)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7335 |
| logD: | 3.626 |
| logSw: | -6.2153 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.87 |
| InChI Key: | BTUTVRKIIZGCDC-WJOKGBTCSA-N |