1-[(3-nitrophenyl)methyl]-3-phenylthieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(3-nitrophenyl)methyl]-3-phenylthieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
1-[(3-nitrophenyl)methyl]-3-phenylthieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
Compound ID: | C241-0975 |
Compound Name: | 1-[(3-nitrophenyl)methyl]-3-phenylthieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
Molecular Weight: | 379.39 |
Molecular Formula: | C19 H13 N3 O4 S |
Smiles: | C(c1cccc(c1)[N+]([O-])=O)N1C(N(C(c2c1ccs2)=O)c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 3.6509 |
logD: | 3.6509 |
logSw: | -4.014 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 65.055 |
InChI Key: | XEDGJIJXQDTABN-UHFFFAOYSA-N |