3-chloro-6-methyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-chloro-6-methyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
3-chloro-6-methyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D491-8283 |
| Compound Name: | 3-chloro-6-methyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzothiophene-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 468.44 |
| Molecular Formula: | C22 H26 Cl N3 O2 S |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccc(C)o1)N1CCN(C)CC1)C(c1c(c2ccc(C)cc2s1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4124 |
| logD: | 3.9324 |
| logSw: | -4.6807 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.957 |
| InChI Key: | LIUSRZQUXRWSHW-KRWDZBQOSA-N |