methyl 2-methyl-5-[(4-methyl-3-nitrobenzene-1-sulfonyl)amino]naphtho[1,2-b]furan-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-5-[(4-methyl-3-nitrobenzene-1-sulfonyl)amino]naphtho[1,2-b]furan-3-carboxylate
methyl 2-methyl-5-[(4-methyl-3-nitrobenzene-1-sulfonyl)amino]naphtho[1,2-b]furan-3-carboxylate
Compound characteristics
Compound ID: | 5591-2113 |
Compound Name: | methyl 2-methyl-5-[(4-methyl-3-nitrobenzene-1-sulfonyl)amino]naphtho[1,2-b]furan-3-carboxylate |
Molecular Weight: | 454.46 |
Molecular Formula: | C22 H18 N2 O7 S |
Smiles: | Cc1ccc(cc1[N+]([O-])=O)S(Nc1cc2c(C(=O)OC)c(C)oc2c2ccccc12)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.8111 |
logD: | 4.6468 |
logSw: | -5.0197 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 102.354 |
InChI Key: | DTPAEORJBDQDBB-UHFFFAOYSA-N |