4-{(2S,4S)-2-(morpholine-4-carbonyl)-4-[(pyridin-3-yl)oxy]pyrrolidine-1-sulfonyl}benzonitrile
Chemical Structure Depiction of
4-{(2S,4S)-2-(morpholine-4-carbonyl)-4-[(pyridin-3-yl)oxy]pyrrolidine-1-sulfonyl}benzonitrile
4-{(2S,4S)-2-(morpholine-4-carbonyl)-4-[(pyridin-3-yl)oxy]pyrrolidine-1-sulfonyl}benzonitrile
Compound characteristics
| Compound ID: | S721-0211 |
| Compound Name: | 4-{(2S,4S)-2-(morpholine-4-carbonyl)-4-[(pyridin-3-yl)oxy]pyrrolidine-1-sulfonyl}benzonitrile |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C21 H22 N4 O5 S |
| Smiles: | C1[C@@H](C(N2CCOCC2)=O)N(C[C@H]1Oc1cccnc1)S(c1ccc(C#N)cc1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.771 |
| logD: | 0.7667 |
| logSw: | -1.8316 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 90.112 |
| InChI Key: | RRCQZJMSPUXWFA-QUCCMNQESA-N |