N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0316 |
| Compound Name: | N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C20 H27 N3 O3 S |
| Smiles: | CC(CCNC(c1ccc(cc1)NC(C1=CSCCO1)=O)=O)N1CCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4724 |
| logD: | -1.9223 |
| logSw: | -2.2982 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.22 |
| InChI Key: | ARWOOKHDVUCFKV-HNNXBMFYSA-N |