C27H28Cl3N7O14S5
TL;DR: C27H28Cl3N7O14S5 (CAS 65180-72-5) is a chemical compound with molecular formula C27H28Cl3N7O14S5 and molecular weight 938.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[bis[2-(2-chloroethylsulfonyl)ethyl]amino]-6-chloro-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid
Also Known As: 2,7-Naphthalenedisulfonic acid, 5-((4-(bis(2-((2-chloroethyl)sulfonyl)ethyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-sulfophenyl)azo)-, 2,7-Naphthalenedisulfonic acid, 5-((4-(bis(2-((2-chloroethyl)sulfonyl)ethyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(2-sulfophenyl)diazenyl)-, 2,7-Naphthalenedisulfonic acid, 5-[[4-[bis[2-[(2-chloroethyl)sulfonyl]ethyl]amino]-6-chloro-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-sulfophenyl)azo]-
| Molecular Formula | C27H28Cl3N7O14S5 |
|---|---|
| Molecular Weight | 938.94 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 372.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 18 |
| Exact Mass | 938.93634 |
| Heavy Atoms | 56 |
| Complexity | 1860.0 |
Chemical Identifiers
| CAS Number | 65180-72-5 |
|---|---|
| SMILES | C1=CC(=CC=C1N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)O)S(=O)(=O)O)NC4=NC(=NC(=N4)Cl)N(CCS(=O)(=O)CCCl)CCS(=O)(=O)CCCl)O)S(=O)(=O)O |
| InChIKey | SCJOJGUFIWRWSC-UHFFFAOYSA-N |
Product Overview
C27H28Cl3N7O14S5 (CAS 65180-72-5), with molecular formula C27H28Cl3N7O14S5 and molecular weight 938.94 g/mol. IUPAC: 5-[[4-[bis[2-(2-chloroethylsulfonyl)ethyl]amino]-6-chloro-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid.
Chemical Property Profile of C27H28Cl3N7O14S5
Property Insights of C27H28Cl3N7O14S5
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C27H28Cl3N7O14S5. The TPSA of 372.0 Ų indicates high polarity, suggesting C27H28Cl3N7O14S5 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C27H28Cl3N7O14S5 has 5 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C27H28Cl3N7O14S5?
The CAS number of C27H28Cl3N7O14S5 is 65180-72-5.
What is the molecular formula of C27H28Cl3N7O14S5?
The molecular formula of C27H28Cl3N7O14S5 is C27H28Cl3N7O14S5.
What is the molecular weight of C27H28Cl3N7O14S5?
The molecular weight of C27H28Cl3N7O14S5 is 938.94 g/mol.
Where can I buy C27H28Cl3N7O14S5?
You can request a quote for C27H28Cl3N7O14S5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C27H28Cl3N7O14S5?
Yes, KEHONG BIO provides custom synthesis services for C27H28Cl3N7O14S5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.