1-({[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl)-6-nitronaphthalen-2-ol
Chemical Structure Depiction of
1-({[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl)-6-nitronaphthalen-2-ol
1-({[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl)-6-nitronaphthalen-2-ol
Compound characteristics
| Compound ID: | 0958-0348 |
| Compound Name: | 1-({[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl)-6-nitronaphthalen-2-ol |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C27 H21 N3 O4 |
| Smiles: | Cc1cc(C)c2c(c1)nc(c1ccc(C)c(c1)/N=C/c1c(ccc3cc(ccc13)[N+]([O-])=O)O)o2 |
| Stereo: | ACHIRAL |
| logP: | 7.0419 |
| logD: | 6.9972 |
| logSw: | -6.0992 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.369 |
| InChI Key: | KYJUFNAOEDBVRD-UHFFFAOYSA-N |