methyl 2-{[5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl]amino}benzoate
methyl 2-{[5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | C201-0340 |
| Compound Name: | methyl 2-{[5-(hydroxymethyl)-2-imino-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 367.36 |
| Molecular Formula: | C19 H17 N3 O5 |
| Smiles: | Cc1c2c(C=C(C(=N)O2)C(Nc2ccccc2C(=O)OC)=O)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | 1.3871 |
| logD: | 1.1018 |
| logSw: | -2.1234 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.557 |
| InChI Key: | BOAGCOPQOUQXKY-UHFFFAOYSA-N |