[4-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenoxy]acetic acid
Chemical Structure Depiction of
[4-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenoxy]acetic acid
[4-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenoxy]acetic acid
Compound characteristics
Compound ID: | 8010-1150 |
Compound Name: | [4-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenoxy]acetic acid |
Molecular Weight: | 425.44 |
Molecular Formula: | C26 H19 N O5 |
Smiles: | C(C(O)=O)Oc1ccc(cc1)N1C(C2C(C3c4ccccc4C2c2ccccc23)C1=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.8763 |
logD: | -1.3607 |
logSw: | -3.2587 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.332 |
InChI Key: | HFCNLQNFSHEDCK-UHFFFAOYSA-N |