[5-(4-methoxyphenyl)-1,2-dimethyl-1H-pyrrol-3-yl]{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone
Chemical Structure Depiction of
[5-(4-methoxyphenyl)-1,2-dimethyl-1H-pyrrol-3-yl]{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone
[5-(4-methoxyphenyl)-1,2-dimethyl-1H-pyrrol-3-yl]{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone
Compound characteristics
| Compound ID: | S517-0093 |
| Compound Name: | [5-(4-methoxyphenyl)-1,2-dimethyl-1H-pyrrol-3-yl]{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C23 H29 N5 O2 |
| Smiles: | Cc1c(cc(c2ccc(cc2)OC)n1C)C(N1CCC(CC1)Cc1nncn1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6639 |
| logD: | 2.6627 |
| logSw: | -3.0384 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.08 |
| InChI Key: | JRXZQPQEEKBECT-UHFFFAOYSA-N |