N-(4-chlorophenyl)-N-[2-(cyclopentylamino)-2-oxoethyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-N-[2-(cyclopentylamino)-2-oxoethyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-(4-chlorophenyl)-N-[2-(cyclopentylamino)-2-oxoethyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | C799-0400 |
| Compound Name: | N-(4-chlorophenyl)-N-[2-(cyclopentylamino)-2-oxoethyl]-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 394.92 |
| Molecular Formula: | C19 H23 Cl N2 O3 S |
| Smiles: | CC1=C(C(N(CC(NC2CCCC2)=O)c2ccc(cc2)[Cl])=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 2.9252 |
| logD: | 2.9252 |
| logSw: | -3.544 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.423 |
| InChI Key: | QPKGSRFELQXXQT-UHFFFAOYSA-N |