RefChem:551656
TL;DR: RefChem:551656 (CAS 35074-30-7) is a chemical compound with molecular formula C19H21BrN6O8 and molecular weight 540.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2-bromo-4,6-dinitrophenyl)diazenyl]-5-[(2-hydroxy-3-methoxypropyl)amino]-4-methoxyphenyl]acetamide
Also Known As: DIMETHYL 2-CHLORO-3-OXO-BUTANEDIOATE, N-[2-[ azo]-5-[ amino]-4-methoxyphenyl]acetamide, Acetamide, N-(2-((2-bromo-4,6-dinitrophenyl)azo)-5-((2-hydroxy-3-methoxypropyl)amino)-4-methoxyphenyl)-, 2-Bromo-4,6-dinitro-2'-acetylamino-4'-(N-beta-hydroxy-gamma-methoxypropylamino)-5'-methoxyazobenzene, Acetamide, N-(2-(2-(2-bromo-4,6-dinitrophenyl)diazenyl)-5-((2-hydroxy-3-methoxypropyl)amino)-4-methoxyphenyl)-
| Molecular Formula | C19H21BrN6O8 |
|---|---|
| Molecular Weight | 540.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 196.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 540.0604 |
| Heavy Atoms | 34 |
| Complexity | 735.0 |
Chemical Identifiers
| CAS Number | 35074-30-7 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)NCC(COC)O |
| InChIKey | CNSSFLHYPQHHJJ-UHFFFAOYSA-N |
Product Overview
RefChem:551656 (CAS 35074-30-7), with molecular formula C19H21BrN6O8 and molecular weight 540.06 g/mol. IUPAC: N-[2-[(2-bromo-4,6-dinitrophenyl)diazenyl]-5-[(2-hydroxy-3-methoxypropyl)amino]-4-methoxyphenyl]acetamide.
Chemical Property Profile of RefChem:551656
Property Insights of RefChem:551656
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:551656. The TPSA of 196.0 Ų indicates high polarity, suggesting RefChem:551656 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:551656 has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:551656?
The CAS number of RefChem:551656 is 35074-30-7.
What is the molecular formula of RefChem:551656?
The molecular formula of RefChem:551656 is C19H21BrN6O8.
What is the molecular weight of RefChem:551656?
The molecular weight of RefChem:551656 is 540.06 g/mol.
Where can I buy RefChem:551656?
You can request a quote for RefChem:551656 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:551656?
Yes, KEHONG BIO provides custom synthesis services for RefChem:551656 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.