1-[{[(1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}(4-methoxyphenyl)amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-[{[(1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}(4-methoxyphenyl)amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide--hydrogen chloride (1/1)
1-[{[(1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}(4-methoxyphenyl)amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8013-0899 |
| Compound Name: | 1-[{[(1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}(4-methoxyphenyl)amino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 582.12 |
| Molecular Formula: | C29 H31 N5 O4 S |
| Salt: | HCl |
| Smiles: | COc1ccc(cc1)NC(C1(CCCCC1)N(C(CSc1nc2c(cccn2)[nH]1)=O)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7019 |
| logD: | 4.6954 |
| logSw: | -4.2601 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.964 |
| InChI Key: | DTXFLUFVYVWVOF-UHFFFAOYSA-N |