propan-2-yl 2-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propan-2-yl 2-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6049-1607 |
| Compound Name: | propan-2-yl 2-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 475.99 |
| Molecular Formula: | C23 H26 Cl N3 O4 S |
| Smiles: | CC(C)OC(c1c2CCCCc2sc1NC(c1ccc(Cn2c(C)c(c(C)n2)[Cl])o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0272 |
| logD: | 2.023 |
| logSw: | -5.3253 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.6 |
| InChI Key: | DWPKTVHTWOEBIG-UHFFFAOYSA-N |