N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0245 |
| Compound Name: | N-[4-({2-[benzyl(methyl)amino]ethyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | CN(CCNC(c1ccc(cc1)NC(C1=CSCCO1)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0691 |
| logD: | 1.699 |
| logSw: | -2.7575 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.307 |
| InChI Key: | MWPMAMUZNKMJMJ-UHFFFAOYSA-N |