2-[3-(4-chloro-1H-pyrazol-1-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-[3-(4-chloro-1H-pyrazol-1-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-[3-(4-chloro-1H-pyrazol-1-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y500-1652 |
| Compound Name: | 2-[3-(4-chloro-1H-pyrazol-1-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 352.84 |
| Molecular Formula: | C15 H17 Cl N4 O2 S |
| Smiles: | C1CCc2c(C1)c(C(N)=O)c(NC(CCn1cc(cn1)[Cl])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 1.036 |
| logD: | 0.4478 |
| logSw: | -2.9912 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.646 |
| InChI Key: | VPNWMUMRGCZPMK-UHFFFAOYSA-N |