N-{3-(3,4-dimethoxyphenyl)-3-[3-(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamido]propanoyl}glycine
Chemical Structure Depiction of
N-{3-(3,4-dimethoxyphenyl)-3-[3-(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamido]propanoyl}glycine
N-{3-(3,4-dimethoxyphenyl)-3-[3-(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamido]propanoyl}glycine
Compound characteristics
| Compound ID: | Y041-1678 |
| Compound Name: | N-{3-(3,4-dimethoxyphenyl)-3-[3-(7-methoxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamido]propanoyl}glycine |
| Molecular Weight: | 540.57 |
| Molecular Formula: | C28 H32 N2 O9 |
| Smiles: | CC1=C(CCC(NC(CC(NCC(O)=O)=O)c2ccc(c(c2)OC)OC)=O)C(=O)Oc2c1ccc(c2C)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7595 |
| logD: | -2.1267 |
| logSw: | -2.6125 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 120.421 |
| InChI Key: | HRPQDVLMESEMGF-FQEVSTJZSA-N |