2-({4-methyl-5-[(morpholin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-({4-methyl-5-[(morpholin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(pyrrolidin-1-yl)ethan-1-one
2-({4-methyl-5-[(morpholin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8018-0027 |
| Compound Name: | 2-({4-methyl-5-[(morpholin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 325.43 |
| Molecular Formula: | C14 H23 N5 O2 S |
| Smiles: | Cn1c(CN2CCOCC2)nnc1SCC(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | -0.3084 |
| logD: | -0.3094 |
| logSw: | -0.4 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.698 |
| InChI Key: | CHNHFMSHOWHKAP-UHFFFAOYSA-N |