methyl 5-carbamoyl-2-[(2-imino-2H-naphtho[1,2-b]pyran-3-carbonyl)amino]-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-carbamoyl-2-[(2-imino-2H-naphtho[1,2-b]pyran-3-carbonyl)amino]-4-methylthiophene-3-carboxylate
methyl 5-carbamoyl-2-[(2-imino-2H-naphtho[1,2-b]pyran-3-carbonyl)amino]-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-6372 |
| Compound Name: | methyl 5-carbamoyl-2-[(2-imino-2H-naphtho[1,2-b]pyran-3-carbonyl)amino]-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 435.46 |
| Molecular Formula: | C22 H17 N3 O5 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(C2=Cc3ccc4ccccc4c3OC2=N)=O)sc1C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6701 |
| logD: | -2.401 |
| logSw: | -3.4982 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 103.007 |
| InChI Key: | CJKRGJATXIYNBP-UHFFFAOYSA-N |