TL;DR: 2,7-Dichloroquinazolin-4-amine (CAS 111218-91-8) is a chemical compound with molecular formula C8H5Cl2N3 and molecular weight 212.98605 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,7-dichloroquinazolin-4-amine
Also Known As: 2,7-dichloroquinazolin-4-amine, 2,6-DICHLOROQUINAZOLIN-4-AMINE, 2,7-dichloro-4-quinazolinamine, 2,7-dichloroquinazoline-4-ylamine, 2,7-dichloro-quinazolin-4-ylamine
| Molecular Formula | C8H5Cl2N3 |
| Molecular Weight | 212.98605 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.98605 Da |
| Heavy Atoms | 13 |
| Complexity | 190.0 |
| SMILES | C1=CC2=C(C=C1Cl)N=C(N=C2N)Cl |
| InChIKey | MRSMJCRTQBMITN-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,7-Dichloroquinazolin-4-amine. With a topological polar surface area (TPSA) of 51.8 Ų, 2,7-Dichloroquinazolin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,7-Dichloroquinazolin-4-amine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,7-Dichloroquinazolin-4-amine is 111218-91-8.
The molecular formula of 2,7-Dichloroquinazolin-4-amine is C8H5Cl2N3.
The molecular weight of 2,7-Dichloroquinazolin-4-amine is 212.98605 g/mol.
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