6-bromo-2-imino-N-(3-methoxyphenyl)-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-2-imino-N-(3-methoxyphenyl)-2H-1-benzopyran-3-carboxamide
6-bromo-2-imino-N-(3-methoxyphenyl)-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | Y200-6602 |
| Compound Name: | 6-bromo-2-imino-N-(3-methoxyphenyl)-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 373.2 |
| Molecular Formula: | C17 H13 Br N2 O3 |
| Smiles: | COc1cccc(c1)NC(C1=Cc2cc(ccc2OC1=N)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5438 |
| logD: | 3.5412 |
| logSw: | -3.8003 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.111 |
| InChI Key: | XIGUJWKDRQPPFR-UHFFFAOYSA-N |