2-methyl-N-(2-{[3-(4-propylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-(2-{[3-(4-propylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
2-methyl-N-(2-{[3-(4-propylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-0245 |
| Compound Name: | 2-methyl-N-(2-{[3-(4-propylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 446.61 |
| Molecular Formula: | C23 H34 N4 O3 S |
| Smiles: | CCCN1CCN(CCCNC(c2ccccc2NC(C2=C(C)OCCS2)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.3715 |
| logD: | 1.3715 |
| logSw: | -2.6021 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.93 |
| InChI Key: | HUGMLOZKNZFGBO-UHFFFAOYSA-N |