1-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-N,N,5-trimethyl-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
1-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-N,N,5-trimethyl-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
1-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-N,N,5-trimethyl-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0200 |
| Compound Name: | 1-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-N,N,5-trimethyl-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 511 |
| Molecular Formula: | C25 H23 Cl N4 O4 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CN1C(N(C(c2c(C)c(C(N(C)C)=O)sc12)=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1553 |
| logD: | 3.1552 |
| logSw: | -3.7032 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.559 |
| InChI Key: | SGCDYQHXJBCIOF-UHFFFAOYSA-N |