TL;DR: (3,5-Dihydroxy-1-methyl-2,3-dihydroindol-6-yl)iminourea (CAS 30552-37-5) is a chemical compound with molecular formula C10H12N4O3 and molecular weight 236.09094 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,5-dihydroxy-1-methyl-2,3-dihydroindol-6-yl)iminourea
Also Known As: Carbazochrome Impurity N4, Carbazochrome Impurity 13, (3,5-Dihydroxy-1-methyl-2,3-dihydroindol-6-yl)iminourea, Carbazochrome Sodium Sulfonate Impurity 8, (1,2,3,5(Or 1,2,3,6)-tetrahydro-3-hydroxy-1-methyl-5(or 6)-oxo-6H(or 5H)-indol-6(or 5)-al) semicarbazone
| Molecular Formula | C10H12N4O3 |
| Molecular Weight | 236.09094 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.09094 Da |
| Heavy Atoms | 17 |
| Complexity | 336.0 |
| SMILES | CN1CC(C2=CC(=C(C=C21)N=NC(=O)N)O)O |
| InChIKey | MLPQKUXROCKTSE-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,5-Dihydroxy-1-methyl-2,3-dihydroindol-6-yl)iminourea. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,5-Dihydroxy-1-methyl-2,3-dihydroindol-6-yl)iminourea. Following Lipinski's Rule of Five, (3,5-Dihydroxy-1-methyl-2,3-dihydroindol-6-yl)iminourea has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (3,5-Dihydroxy-1-methyl-2,3-dihydroindol-6-yl)iminourea is 30552-37-5.
The molecular formula of (3,5-Dihydroxy-1-methyl-2,3-dihydroindol-6-yl)iminourea is C10H12N4O3.
The molecular weight of (3,5-Dihydroxy-1-methyl-2,3-dihydroindol-6-yl)iminourea is 236.09094 g/mol.
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