1-(6-bromo-1H-indazol-3-yl)-4-(thiomorpholine-4-carbonyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-(6-bromo-1H-indazol-3-yl)-4-(thiomorpholine-4-carbonyl)pyrrolidin-2-one
1-(6-bromo-1H-indazol-3-yl)-4-(thiomorpholine-4-carbonyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | J106-0713 |
| Compound Name: | 1-(6-bromo-1H-indazol-3-yl)-4-(thiomorpholine-4-carbonyl)pyrrolidin-2-one |
| Molecular Weight: | 409.3 |
| Molecular Formula: | C16 H17 Br N4 O2 S |
| Smiles: | C1C(CN(C1=O)c1c2ccc(cc2[nH]n1)[Br])C(N1CCSCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1802 |
| logD: | 2.1802 |
| logSw: | -2.8729 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.046 |
| InChI Key: | YEDZLWQTKYZEAF-SNVBAGLBSA-N |