1-{(2S)-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-4,4-difluoropyrrolidin-1-yl}-3-phenylpropan-1-one
Chemical Structure Depiction of
1-{(2S)-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-4,4-difluoropyrrolidin-1-yl}-3-phenylpropan-1-one
1-{(2S)-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-4,4-difluoropyrrolidin-1-yl}-3-phenylpropan-1-one
Compound characteristics
| Compound ID: | S970-0443 |
| Compound Name: | 1-{(2S)-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-4,4-difluoropyrrolidin-1-yl}-3-phenylpropan-1-one |
| Molecular Weight: | 360.41 |
| Molecular Formula: | C19 H22 F2 N4 O |
| Smiles: | C(Cc1ccccc1)C(N1CC(C[C@H]1c1nncn1CC1CC1)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7853 |
| logD: | 2.7853 |
| logSw: | -2.9773 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.961 |
| InChI Key: | VYPUZVLLRWGAGH-MRXNPFEDSA-N |