4-amino-2-(benzylamino)-5-(4-chlorobenzoyl)thiophene-3-carbonitrile
Chemical Structure Depiction of
4-amino-2-(benzylamino)-5-(4-chlorobenzoyl)thiophene-3-carbonitrile
4-amino-2-(benzylamino)-5-(4-chlorobenzoyl)thiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 8017-9273 |
| Compound Name: | 4-amino-2-(benzylamino)-5-(4-chlorobenzoyl)thiophene-3-carbonitrile |
| Molecular Weight: | 367.85 |
| Molecular Formula: | C19 H14 Cl N3 O S |
| Smiles: | C(c1ccccc1)Nc1c(C#N)c(c(C(c2ccc(cc2)[Cl])=O)s1)N |
| Stereo: | ACHIRAL |
| logP: | 4.2791 |
| logD: | 4.2791 |
| logSw: | -4.9924 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 60.177 |
| InChI Key: | ZTOPOXNWKHNGMZ-UHFFFAOYSA-N |