2-chlorophenyl 2-{[2-(dipropylamino)-2-oxoethyl]sulfanyl}pyridine-3-carboxylate
Chemical Structure Depiction of
2-chlorophenyl 2-{[2-(dipropylamino)-2-oxoethyl]sulfanyl}pyridine-3-carboxylate
2-chlorophenyl 2-{[2-(dipropylamino)-2-oxoethyl]sulfanyl}pyridine-3-carboxylate
Compound characteristics
| Compound ID: | K786-2015 |
| Compound Name: | 2-chlorophenyl 2-{[2-(dipropylamino)-2-oxoethyl]sulfanyl}pyridine-3-carboxylate |
| Molecular Weight: | 406.93 |
| Molecular Formula: | C20 H23 Cl N2 O3 S |
| Smiles: | CCCN(CCC)C(CSc1c(cccn1)C(=O)Oc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3803 |
| logD: | 4.3803 |
| logSw: | -4.5895 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.794 |
| InChI Key: | UISGSACJOBWOPP-UHFFFAOYSA-N |