3-(3-{2-[2-(4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-3-oxopropyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-(3-{2-[2-(4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-3-oxopropyl)-1,3-benzoxazol-2(3H)-one
3-(3-{2-[2-(4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-3-oxopropyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | SD73-0111 |
| Compound Name: | 3-(3-{2-[2-(4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-3-oxopropyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 383.45 |
| Molecular Formula: | C20 H25 N5 O3 |
| Smiles: | CCn1cnnc1CCC1CCCN1C(CCN1C(=O)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2884 |
| logD: | 1.2883 |
| logSw: | -1.9583 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.507 |
| InChI Key: | ALEIZJMSPZXWHE-OAHLLOKOSA-N |