1-[2-(azepan-1-yl)-2-oxoethyl]-3-(3-methoxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[2-(azepan-1-yl)-2-oxoethyl]-3-(3-methoxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
1-[2-(azepan-1-yl)-2-oxoethyl]-3-(3-methoxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C242-0448 |
| Compound Name: | 1-[2-(azepan-1-yl)-2-oxoethyl]-3-(3-methoxyphenyl)-5,6-dimethylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | Cc1c2C(N(C(N(CC(N3CCCCCC3)=O)c2sc1C)=O)c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5931 |
| logD: | 3.5931 |
| logSw: | -3.9032 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.374 |
| InChI Key: | MCSUGEUIBODBNU-UHFFFAOYSA-N |