2-methyl-N-(4-{[3-(2-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-(4-{[3-(2-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
2-methyl-N-(4-{[3-(2-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-1633 |
| Compound Name: | 2-methyl-N-(4-{[3-(2-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C22 H31 N3 O3 S |
| Smiles: | CC1CCCCN1CCCNC(c1ccc(cc1)NC(C1=C(C)OCCS1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.68 |
| logD: | 1.68 |
| logSw: | -2.6795 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.288 |
| InChI Key: | MDIABGCDXNQEAE-INIZCTEOSA-N |