2-(4-methoxyphenyl)-1,3-diphenyl-4-(pyrrolidin-1-yl)butan-2-ol--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(4-methoxyphenyl)-1,3-diphenyl-4-(pyrrolidin-1-yl)butan-2-ol--hydrogen chloride (1/1)
2-(4-methoxyphenyl)-1,3-diphenyl-4-(pyrrolidin-1-yl)butan-2-ol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D168-0026 |
| Compound Name: | 2-(4-methoxyphenyl)-1,3-diphenyl-4-(pyrrolidin-1-yl)butan-2-ol--hydrogen chloride (1/1) |
| Molecular Weight: | 438.01 |
| Molecular Formula: | C27 H31 N O2 |
| Salt: | HCl |
| Smiles: | COc1ccc(cc1)C(Cc1ccccc1)(C(CN1CCCC1)c1ccccc1)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3171 |
| logD: | 3.4776 |
| logSw: | -5.2733 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.8732 |
| InChI Key: | DKUMZXJYEPSKRY-UHFFFAOYSA-N |