2,2'-(6,6-dimethyl-2,4-dioxo-5,8-dihydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-1,3(4H,6H)-diyl)diacetic acid
Chemical Structure Depiction of
2,2'-(6,6-dimethyl-2,4-dioxo-5,8-dihydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-1,3(4H,6H)-diyl)diacetic acid
2,2'-(6,6-dimethyl-2,4-dioxo-5,8-dihydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-1,3(4H,6H)-diyl)diacetic acid
Compound characteristics
| Compound ID: | 8640-0200 |
| Compound Name: | 2,2'-(6,6-dimethyl-2,4-dioxo-5,8-dihydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-1,3(4H,6H)-diyl)diacetic acid |
| Molecular Weight: | 368.36 |
| Molecular Formula: | C15 H16 N2 O7 S |
| Smiles: | [H]OC(CN1C(c2c3CC(C)(C)OCc3sc2N(CC(=O)O[H])C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.7257 |
| logD: | -4.7535 |
| logSw: | -0.7158 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.647 |
| InChI Key: | OVPNXDJVNOWQTJ-UHFFFAOYSA-N |