N-[(6-methyl-8-oxo-3,4-dihydro-8H-spiro[benzo[1,2-b:5,4-b']dipyran-2,1'-cyclohexan]-7-yl)acetyl]norvalylglycine
Chemical Structure Depiction of
N-[(6-methyl-8-oxo-3,4-dihydro-8H-spiro[benzo[1,2-b:5,4-b']dipyran-2,1'-cyclohexan]-7-yl)acetyl]norvalylglycine
N-[(6-methyl-8-oxo-3,4-dihydro-8H-spiro[benzo[1,2-b:5,4-b']dipyran-2,1'-cyclohexan]-7-yl)acetyl]norvalylglycine
Compound characteristics
| Compound ID: | Y041-1679 |
| Compound Name: | N-[(6-methyl-8-oxo-3,4-dihydro-8H-spiro[benzo[1,2-b:5,4-b']dipyran-2,1'-cyclohexan]-7-yl)acetyl]norvalylglycine |
| Molecular Weight: | 498.58 |
| Molecular Formula: | C27 H34 N2 O7 |
| Smiles: | CCCC(C(NCC(O)=O)=O)NC(CC1=C(C)c2cc3CCC4(CCCCC4)Oc3cc2OC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.122 |
| logD: | -0.8062 |
| logSw: | -3.2473 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.066 |
| InChI Key: | WJTSOUYLZPBWJZ-FQEVSTJZSA-N |