N-(3-chloro-4-methoxyphenyl)-2-[6-methyl-5-(4-methylpiperazine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[6-methyl-5-(4-methylpiperazine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[6-methyl-5-(4-methylpiperazine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | C138-1124 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[6-methyl-5-(4-methylpiperazine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 526.03 |
| Molecular Formula: | C21 H24 Cl N5 O5 S2 |
| Smiles: | Cc1c(c2C(N(CC(Nc3ccc(c(c3)[Cl])OC)=O)C=Nc2s1)=O)S(N1CCN(C)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6132 |
| logD: | 1.5504 |
| logSw: | -3.1549 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.209 |
| InChI Key: | NJWPCOUGSGMCRI-UHFFFAOYSA-N |