TL;DR: 6,7-Dimethoxy-4-semicarbazidoquinazoline hydrochloride dihydrate (CAS 134749-18-1) is a chemical compound with molecular formula C11H14ClN5O3 and molecular weight 299.07852 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(6,7-dimethoxyquinazolin-4-yl)amino]urea;hydrochloride
Also Known As: 6,7-Dimethoxy-4-semicarbazidoquinazoline hydrochloride dihydrate, Hydrazinecarboxamide, 2-(6,7-dimethoxy-4-quinazolinyl)-, monohydrochloride, dihydrate, 2-(6,7-Dimethoxy-4-quinazolinyl)hydrazinecarboxamide monohydrochloride dihydrate, [(6,7-dimethoxyquinazolin-4-yl)amino]urea,hydrochloride, [(6,7-dimethoxyquinazolin-4-yl)amino]urea hydrochloride
| Molecular Formula | C11H14ClN5O3 |
| Molecular Weight | 299.07852 g/mol |
| XLogP | 1.064 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.07852 Da |
| Heavy Atoms | 20 |
| Complexity | 317.0 |
| SMILES | COC1=C(C=C2C(=C1)C(=NC=N2)NNC(=O)N)OC.Cl |
| InChIKey | ORBCKUIUFKIKQG-UHFFFAOYSA-N |
The XLogP value of 1.064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dimethoxy-4-semicarbazidoquinazoline hydrochloride dihydrate. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-Dimethoxy-4-semicarbazidoquinazoline hydrochloride dihydrate. Following Lipinski's Rule of Five, 6,7-Dimethoxy-4-semicarbazidoquinazoline hydrochloride dihydrate has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6,7-Dimethoxy-4-semicarbazidoquinazoline hydrochloride dihydrate is 134749-18-1.
The molecular formula of 6,7-Dimethoxy-4-semicarbazidoquinazoline hydrochloride dihydrate is C11H14ClN5O3.
The molecular weight of 6,7-Dimethoxy-4-semicarbazidoquinazoline hydrochloride dihydrate is 299.07852 g/mol.
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