Val-NMHE
TL;DR: Val-NMHE (CAS 89683-26-1) is a chemical compound with molecular formula C23H24N3O3+ and molecular weight 390.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(9-hydroxy-2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-10-yl)imino]-3-methylbutanoic acid
Also Known As: Val-NMHE, 6H-Pyrido(4,3-b)carbazolium, 10-((1-carboxy-2-methylpropylidene)amino)-9-hydroxy-2,5,11-trimethyl-, 10-((1-Carboxy-2-methylpropylidene)amino)-9-hydroxy-2-methylellipticinium, 2-[(9-hydroxy-2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-10-yl)imino]-3-methylbutanoic acid
| Molecular Formula | C23H24N3O3+ |
|---|---|
| Molecular Weight | 390.18 g/mol |
| LogP | 4.43434 |
| Topological Polar Surface Area | 89.56 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.18176 |
| Heavy Atoms | 29 |
| Complexity | 1346.7444 |
Chemical Identifiers
| CAS Number | 89683-26-1 |
|---|---|
| SMILES | CC1=C2C=C[N+](=CC2=C(C3=C1NC4=C3C(=C(C=C4)O)N=C(C(C)C)C(=O)O)C)C |
Product Overview
Val-NMHE (CAS 89683-26-1), with molecular formula C23H24N3O3+ and molecular weight 390.18 g/mol. IUPAC: 2-[(9-hydroxy-2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium-10-yl)imino]-3-methylbutanoic acid.
Chemical Property Profile of Val-NMHE
Property Insights of Val-NMHE
The XLogP value of 4.43434 indicates that Val-NMHE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Val-NMHE. Following Lipinski's Rule of Five, Val-NMHE has 3 hydrogen bond donor(s) and 3 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 Val-NMHE?
The CAS number of Val-NMHE is 89683-26-1.
What is the molecular formula of Val-NMHE?
The molecular formula of Val-NMHE is C23H24N3O3+.
What is the molecular weight of Val-NMHE?
The molecular weight of Val-NMHE is 390.18 g/mol.
Where can I buy Val-NMHE?
You can request a quote for Val-NMHE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Val-NMHE?
Yes, KEHONG BIO provides custom synthesis services for Val-NMHE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.