ethyl 4-(3-chloro-4-methylanilino)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 4-(3-chloro-4-methylanilino)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate--hydrogen chloride (1/1)
ethyl 4-(3-chloro-4-methylanilino)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3909-7556 |
| Compound Name: | ethyl 4-(3-chloro-4-methylanilino)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 412.34 |
| Molecular Formula: | C18 H18 Cl N3 O2 S |
| Salt: | HCl |
| Smiles: | CCOC(c1c(C)c2c(Nc3ccc(C)c(c3)[Cl])nc(C)nc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9003 |
| logD: | 5.8091 |
| logSw: | -6.0892 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.833 |
| InChI Key: | XWQJBNYYZDKZHC-UHFFFAOYSA-N |