![6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile structure](/static/products/1048/1048915-35-0.webp)
6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile
TL;DR: 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile (CAS 1048915-35-0) is a chemical compound with molecular formula C21H14F3N5O2 and molecular weight 425.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile
Also Known As: 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile, 5-(1-AZA-4-PHENYLBUTA-1,3-DIENYL)-4-IMINO-2-OXO-3-(4-(TRIFLUOROMETHOXY)PHENYL)-1H-1,3-DIAZINE-6-CARBONITRILE, 6-imino-2-oxo-5-{[(E,2E)-3-phenyl-2-propenylidene]amino}-1-[4-(trifluoromethoxy)phenyl]-1,2,3,6-tetrahydro-4-pyrimidinecarbonitrile, C21H14F3N5O2
| Molecular Formula | C21H14F3N5O2 |
|---|---|
| Molecular Weight | 425.11 g/mol |
| LogP | 4.00068 |
| Topological Polar Surface Area | 106.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.10995 |
| Heavy Atoms | 31 |
| Complexity | 1225.3457 |
Chemical Identifiers
| CAS Number | 1048915-35-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC=NC2=C(N(C(=O)N=C2C#N)C3=CC=C(C=C3)OC(F)(F)F)N |
Product Overview
6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile (CAS 1048915-35-0), with molecular formula C21H14F3N5O2 and molecular weight 425.11 g/mol. IUPAC: 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile.
Chemical Property Profile of 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile
Property Insights of 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile
The XLogP value of 4.00068 indicates that 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile. Following Lipinski's Rule of Five, 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile has 1 hydrogen bond donor(s) and 6 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 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile?
The CAS number of 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile is 1048915-35-0.
What is the molecular formula of 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile?
The molecular formula of 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile is C21H14F3N5O2.
What is the molecular weight of 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile?
The molecular weight of 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile is 425.11 g/mol.
Where can I buy 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile?
You can request a quote for 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-amino-5-(cinnamylideneamino)-2-oxo-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.