3-chloro-N-{[1-(dimethylamino)cyclohexyl]methyl}-6-methyl-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-chloro-N-{[1-(dimethylamino)cyclohexyl]methyl}-6-methyl-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
3-chloro-N-{[1-(dimethylamino)cyclohexyl]methyl}-6-methyl-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D335-0073 |
| Compound Name: | 3-chloro-N-{[1-(dimethylamino)cyclohexyl]methyl}-6-methyl-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 401.4 |
| Molecular Formula: | C19 H25 Cl N2 O S |
| Salt: | HCl |
| Smiles: | Cc1ccc2c(c(C(NCC3(CCCCC3)N(C)C)=O)sc2c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1472 |
| logD: | 4.0824 |
| logSw: | -5.4736 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.984 |
| InChI Key: | OMMXMNPTUQPQNO-UHFFFAOYSA-N |