N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-chloropyridine-3-carboxamide
Chemical Structure Depiction of
N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-chloropyridine-3-carboxamide
N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-chloropyridine-3-carboxamide
Compound characteristics
| Compound ID: | Y503-0264 |
| Compound Name: | N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-chloropyridine-3-carboxamide |
| Molecular Weight: | 349.84 |
| Molecular Formula: | C16 H16 Cl N3 O2 S |
| Smiles: | C1CCc2c(C(N)=O)c(NC(c3cccnc3[Cl])=O)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.8999 |
| logD: | -0.9443 |
| logSw: | -3.4075 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 67.12 |
| InChI Key: | JXRFAKONUCSMNR-UHFFFAOYSA-N |