1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-3-(3-methoxyphenyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-3-(3-methoxyphenyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-3-(3-methoxyphenyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0117 |
| Compound Name: | 1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-3-(3-methoxyphenyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 580.66 |
| Molecular Formula: | C29 H32 N4 O7 S |
| Smiles: | Cc1c2C(N(C(N(CC(NCCc3ccc(c(c3)OC)OC)=O)c2sc1C(N(C)C)=O)=O)c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5864 |
| logD: | 1.5864 |
| logSw: | -2.6219 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.225 |
| InChI Key: | BCGUSKFEVRNUIN-UHFFFAOYSA-N |