RefChem:283912
TL;DR: RefChem:283912 (CAS 75159-29-4) is a chemical compound with molecular formula C17H20Cl2N4O and molecular weight 366.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(4-methylanilino)methylamino]methyl]quinazolin-4-one;dihydrochloride
Also Known As: 4(3H)-Quinazolinone, 3-(((((4-methylphenyl)amino)methyl)amino)methyl)-, dihydrochloride, 3-(((((4-Methylphenyl)amino)methyl)amino)methyl)-4(3H)-quinazolinone dihydrochloride, 3-[[(4-methylanilino)methylamino]methyl]quinazolin-4-one dihydrochloride, 3-({[(4-Methylanilino)methyl]amino}methyl)quinazolin-4(3H)-one--hydrogen chloride (1/2), RefChem:283912
| Molecular Formula | C17H20Cl2N4O |
|---|---|
| Molecular Weight | 366.10 g/mol |
| LogP | 3.17 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.1014 |
| Heavy Atoms | 24 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 75159-29-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCNCN2C=NC3=CC=CC=C3C2=O.Cl.Cl |
| InChIKey | LVGXQDIIBJWUSK-UHFFFAOYSA-N |
Product Overview
RefChem:283912 (CAS 75159-29-4), with molecular formula C17H20Cl2N4O and molecular weight 366.10 g/mol. IUPAC: 3-[[(4-methylanilino)methylamino]methyl]quinazolin-4-one;dihydrochloride.
Chemical Property Profile of RefChem:283912
Property Insights of RefChem:283912
The XLogP value of 3.17 indicates that RefChem:283912 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.7 Ų, RefChem:283912 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:283912 has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:283912?
The CAS number of RefChem:283912 is 75159-29-4.
What is the molecular formula of RefChem:283912?
The molecular formula of RefChem:283912 is C17H20Cl2N4O.
What is the molecular weight of RefChem:283912?
The molecular weight of RefChem:283912 is 366.10 g/mol.
Where can I buy RefChem:283912?
You can request a quote for RefChem:283912 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:283912?
Yes, KEHONG BIO provides custom synthesis services for RefChem:283912 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.