N~5~-carbamoyl-N~2~-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-ornithine
Chemical Structure Depiction of
N~5~-carbamoyl-N~2~-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-ornithine
N~5~-carbamoyl-N~2~-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-ornithine
Compound characteristics
| Compound ID: | Y041-1720 |
| Compound Name: | N~5~-carbamoyl-N~2~-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-ornithine |
| Molecular Weight: | 425.82 |
| Molecular Formula: | C18 H20 Cl N3 O7 |
| Smiles: | CC1=C(CC(N[C@H](CCCNC(N)=O)C(O)=O)=O)C(=O)Oc2cc(c(cc12)[Cl])O |
| Stereo: | ABSOLUTE |
| logP: | 0.0457 |
| logD: | -3.5722 |
| logSw: | -2.3133 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 135.442 |
| InChI Key: | UQZGQPSBIROLEM-LBPRGKRZSA-N |