3,6-diamino-2-(4-chlorobenzoyl)-4-(4-methylphenyl)thieno[2,3-b]pyridine-5-carbonitrile
Chemical Structure Depiction of
3,6-diamino-2-(4-chlorobenzoyl)-4-(4-methylphenyl)thieno[2,3-b]pyridine-5-carbonitrile
3,6-diamino-2-(4-chlorobenzoyl)-4-(4-methylphenyl)thieno[2,3-b]pyridine-5-carbonitrile
Compound characteristics
| Compound ID: | 4729-0524 |
| Compound Name: | 3,6-diamino-2-(4-chlorobenzoyl)-4-(4-methylphenyl)thieno[2,3-b]pyridine-5-carbonitrile |
| Molecular Weight: | 418.9 |
| Molecular Formula: | C22 H15 Cl N4 O S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(N)nc2c1c(c(C(c1ccc(cc1)[Cl])=O)s2)N |
| Stereo: | ACHIRAL |
| logP: | 5.4234 |
| logD: | 5.4234 |
| logSw: | -6.2747 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 80.293 |
| InChI Key: | IRKFZXQBWHVOTJ-UHFFFAOYSA-N |