3-chloro-2,2-dimethyl-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)propan-1-one
Chemical Structure Depiction of
3-chloro-2,2-dimethyl-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)propan-1-one
3-chloro-2,2-dimethyl-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)propan-1-one
Compound characteristics
| Compound ID: | V028-8819 |
| Compound Name: | 3-chloro-2,2-dimethyl-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)propan-1-one |
| Molecular Weight: | 290.79 |
| Molecular Formula: | C16 H19 Cl N2 O |
| Salt: | not_available |
| Smiles: | CC(C)(C[Cl])C(N1CCc2c(C1)c1ccccc1[nH]2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.821 |
| logD: | 2.821 |
| logSw: | -3.1543 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.6701 |
| InChI Key: | JJQLGZVSRWPQOI-UHFFFAOYSA-N |