![5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e structure](/static/products/2009/20096-59-7.webp)
5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e
TL;DR: 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e (CAS 20096-59-7) is a chemical compound with molecular formula C27H24Cl2FN5O3S and molecular weight 587.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoyl]-2-methylbenzenesulfonyl fluoride
Also Known As: 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e, 5-{[(4-{2-[2,6-Diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl}phenyl)methyl]carbamoyl}-2-methylbenzene-1-sulfonyl fluoride, 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoyl]-2-methylbenzenesulfonyl fluoride
| Molecular Formula | C27H24Cl2FN5O3S |
|---|---|
| Molecular Weight | 587.10 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 587.09607 |
| Heavy Atoms | 39 |
| Complexity | 920.0 |
Chemical Identifiers
| CAS Number | 20096-59-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)CCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl)S(=O)(=O)F |
| InChIKey | CAQZTQSTZPPTKP-UHFFFAOYSA-N |
Product Overview
5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e (CAS 20096-59-7), with molecular formula C27H24Cl2FN5O3S and molecular weight 587.10 g/mol. IUPAC: 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoyl]-2-methylbenzenesulfonyl fluoride.
Chemical Property Profile of 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e
Property Insights of 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e
The XLogP value of 5.6 indicates that 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e?
The CAS number of 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e is 20096-59-7.
What is the molecular formula of 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e?
The molecular formula of 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e is C27H24Cl2FN5O3S.
What is the molecular weight of 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e?
The molecular weight of 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e is 587.10 g/mol.
Where can I buy 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e?
You can request a quote for 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e?
Yes, KEHONG BIO provides custom synthesis services for 5-[[4-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]e and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.