4-amino-5-(4-chlorobenzoyl)-2-(2-methylanilino)thiophene-3-carbonitrile
Chemical Structure Depiction of
4-amino-5-(4-chlorobenzoyl)-2-(2-methylanilino)thiophene-3-carbonitrile
4-amino-5-(4-chlorobenzoyl)-2-(2-methylanilino)thiophene-3-carbonitrile
Compound characteristics
| Compound ID: | K264-0002 |
| Compound Name: | 4-amino-5-(4-chlorobenzoyl)-2-(2-methylanilino)thiophene-3-carbonitrile |
| Molecular Weight: | 367.85 |
| Molecular Formula: | C19 H14 Cl N3 O S |
| Smiles: | Cc1ccccc1Nc1c(C#N)c(c(C(c2ccc(cc2)[Cl])=O)s1)N |
| Stereo: | ACHIRAL |
| logP: | 4.8335 |
| logD: | 4.8335 |
| logSw: | -5.1149 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 58.157 |
| InChI Key: | SNFAOCQLPNFWRA-UHFFFAOYSA-N |