N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3-propyl-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3-propyl-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3-propyl-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K840-0349 |
| Compound Name: | N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3-propyl-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 402.43 |
| Molecular Formula: | C18 H18 N4 O5 S |
| Smiles: | CCCN1C=Nc2c(C1=O)c(C)c(C(Nc1cc(ccc1OC)[N+]([O-])=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.6685 |
| logD: | 1.2852 |
| logSw: | -3.1021 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.896 |
| InChI Key: | SUYVAHPRQGFEOP-UHFFFAOYSA-N |