3-benzyl-6,6-dimethyl-1-(prop-2-en-1-yl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Chemical Structure Depiction of
3-benzyl-6,6-dimethyl-1-(prop-2-en-1-yl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
3-benzyl-6,6-dimethyl-1-(prop-2-en-1-yl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | 8640-0181 |
| Compound Name: | 3-benzyl-6,6-dimethyl-1-(prop-2-en-1-yl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C21 H22 N2 O3 S |
| Smiles: | CC1(C)Cc2c3C(N(Cc4ccccc4)C(N(CC=C)c3sc2CO1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4842 |
| logD: | 4.4842 |
| logSw: | -4.667 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.586 |
| InChI Key: | KMFJTBJJGFHYOD-UHFFFAOYSA-N |