2-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-4H-naphtho[1,2-b]pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-4H-naphtho[1,2-b]pyran-3-carbonitrile
2-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-4H-naphtho[1,2-b]pyran-3-carbonitrile
Compound characteristics
| Compound ID: | 4243-0190 |
| Compound Name: | 2-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-4H-naphtho[1,2-b]pyran-3-carbonitrile |
| Molecular Weight: | 423.26 |
| Molecular Formula: | C21 H15 Br N2 O3 |
| Smiles: | COc1cc(cc(c1O)[Br])C1C(C#N)=C(N)Oc2c1ccc1ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0863 |
| logD: | 4.0544 |
| logSw: | -4.4831 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.816 |
| InChI Key: | NEFIPXIZRZHQJX-SFHVURJKSA-N |