N-[2-({3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-[2-({3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-[2-({3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0987 |
| Compound Name: | N-[2-({3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 494.66 |
| Molecular Formula: | C27 H34 N4 O3 S |
| Smiles: | CC1CN(CCCNC(c2ccccc2NC(C2=CSCCO2)=O)=O)CCN1c1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4211 |
| logD: | 2.8947 |
| logSw: | -3.7558 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.977 |
| InChI Key: | RVHXWJQVIHVMSG-NRFANRHFSA-N |