4-[(N-{[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}norvalyl)amino]butanoic acid
Chemical Structure Depiction of
4-[(N-{[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}norvalyl)amino]butanoic acid
4-[(N-{[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}norvalyl)amino]butanoic acid
Compound characteristics
| Compound ID: | Y041-1323 |
| Compound Name: | 4-[(N-{[(6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}norvalyl)amino]butanoic acid |
| Molecular Weight: | 458.51 |
| Molecular Formula: | C24 H30 N2 O7 |
| Smiles: | CCCC(C(NCCCC(O)=O)=O)NC(COc1ccc2C3CCCCC=3C(=O)Oc2c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2615 |
| logD: | -0.5594 |
| logSw: | -2.8823 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.592 |
| InChI Key: | ZKSQIOHGIKKUOQ-IBGZPJMESA-N |