1-[(3-chlorophenyl)methyl]-N,N-diethyl-5-methyl-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
1-[(3-chlorophenyl)methyl]-N,N-diethyl-5-methyl-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
1-[(3-chlorophenyl)methyl]-N,N-diethyl-5-methyl-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0308 |
| Compound Name: | 1-[(3-chlorophenyl)methyl]-N,N-diethyl-5-methyl-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 482 |
| Molecular Formula: | C25 H24 Cl N3 O3 S |
| Smiles: | CCN(CC)C(c1c(C)c2C(N(C(N(Cc3cccc(c3)[Cl])c2s1)=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7354 |
| logD: | 4.7354 |
| logSw: | -5.0092 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.039 |
| InChI Key: | BIVCOGBLCHBEDS-UHFFFAOYSA-N |