N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine
TL;DR: N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine (CAS 597545-76-1) is a chemical compound with molecular formula C22H23F3N6O3 and molecular weight 476.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2-morpholin-4-ylquinazolin-4-yl)-N-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine
Also Known As: N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine, N'-(2-morpholin-4-ylquinazolin-4-yl)-N-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine, N-(2-morpholin-4-ylquinazolin-4-yl)-N'-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine, N-(2-MORPHOLINO-4-QUINAZOLINYL)-N-{3-[2-NITRO-4-(TRIFLUOROMETHYL)ANILINO]PROPYL}AMINE, N-[2-(4-morpholinyl)-4-quinazolinyl]-N'-[2-nitro-4-(trifluoromethyl)phenyl]-1,3-propanediamine
| Molecular Formula | C22H23F3N6O3 |
|---|---|
| Molecular Weight | 476.18 g/mol |
| LogP | 4.3075 |
| Topological Polar Surface Area | 105.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 476.17838 |
| Heavy Atoms | 34 |
| Complexity | 1168.3204 |
Chemical Identifiers
| CAS Number | 597545-76-1 |
|---|---|
| SMILES | C1COCCN1C2=NC3=CC=CC=C3C(=N2)NCCCNC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-] |
Product Overview
N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine (CAS 597545-76-1), with molecular formula C22H23F3N6O3 and molecular weight 476.18 g/mol. IUPAC: N'-(2-morpholin-4-ylquinazolin-4-yl)-N-[2-nitro-4-(trifluoromethyl)phenyl]propane-1,3-diamine.
Chemical Property Profile of N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine
Property Insights of N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine
The XLogP value of 4.3075 indicates that N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine. Following Lipinski's Rule of Five, N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine has 2 hydrogen bond donor(s) and 8 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 N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine?
The CAS number of N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine is 597545-76-1.
What is the molecular formula of N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine?
The molecular formula of N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine is C22H23F3N6O3.
What is the molecular weight of N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine?
The molecular weight of N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine is 476.18 g/mol.
Where can I buy N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine?
You can request a quote for N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine?
Yes, KEHONG BIO provides custom synthesis services for N1-(2-morpholinoquinazolin-4-yl)-N3-(2-nitro-4-(trifluoromethyl)phenyl)propane-1,3-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.