3,6-diamino-4-(3,4-dimethoxyphenyl)-2-(4-methylbenzoyl)thieno[2,3-b]pyridine-5-carbonitrile
Chemical Structure Depiction of
3,6-diamino-4-(3,4-dimethoxyphenyl)-2-(4-methylbenzoyl)thieno[2,3-b]pyridine-5-carbonitrile
3,6-diamino-4-(3,4-dimethoxyphenyl)-2-(4-methylbenzoyl)thieno[2,3-b]pyridine-5-carbonitrile
Compound characteristics
| Compound ID: | 8009-7622 |
| Compound Name: | 3,6-diamino-4-(3,4-dimethoxyphenyl)-2-(4-methylbenzoyl)thieno[2,3-b]pyridine-5-carbonitrile |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C24 H20 N4 O3 S |
| Smiles: | Cc1ccc(cc1)C(c1c(c2c(c3ccc(c(c3)OC)OC)c(C#N)c(N)nc2s1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2284 |
| logD: | 4.2284 |
| logSw: | -4.8074 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 95.554 |
| InChI Key: | CLGRCLXEQMFLRT-UHFFFAOYSA-N |