N~2~-[(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-N~5~-carbamoyl-D-ornithine
Chemical Structure Depiction of
N~2~-[(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-N~5~-carbamoyl-D-ornithine
N~2~-[(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-N~5~-carbamoyl-D-ornithine
Compound characteristics
| Compound ID: | Y041-2095 |
| Compound Name: | N~2~-[(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetyl]-N~5~-carbamoyl-D-ornithine |
| Molecular Weight: | 471.51 |
| Molecular Formula: | C24 H29 N3 O7 |
| Smiles: | CC1=C(CC(N[C@H](CCCNC(N)=O)C(O)=O)=O)C(=O)Oc2cc3c(cc12)c(co3)C(C)(C)C |
| Stereo: | ABSOLUTE |
| logP: | 1.2988 |
| logD: | -2.3191 |
| logSw: | -1.9436 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 128.454 |
| InChI Key: | JQUBPNHIXRNMHI-KRWDZBQOSA-N |