C38H30N10O9S
TL;DR: C38H30N10O9S (CAS 85136-01-2) is a chemical compound with molecular formula C38H30N10O9S and molecular weight 802.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-[[4-[4-[(2E)-2-[6-amino-5-(2H-benzotriazol-4-yldiazenyl)-1-oxo-3-sulfonaphthalen-2-ylidene]hydrazinyl]-3-methoxyphenyl]-2-methoxyphenyl]hydrazinylidene]-4-methyl-6-oxocyclohexa-1,4-diene-1-carboxylic acid
Also Known As: EINECS 285-723-1, 5-((4'-((6-Amino-5-(1H-benzotriazol-4-ylazo)-1-hydroxy-3-sulpho-2-naphthyl)azo)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)azo)-2-hydroxy-4-methylbenzoic acid, 5-[[4'-[[6-amino-5-(1H-benzotriazol-4-ylazo)-1-hydroxy-3-sulpho-2-naphthyl]azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-2-hydroxy-4-methylbenzoic acid
| Molecular Formula | C38H30N10O9S |
|---|---|
| Molecular Weight | 802.19 g/mol |
| LogP | 5.8407 |
| Topological Polar Surface Area | 285.36 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 11 |
| Exact Mass | 802.1918 |
| Heavy Atoms | 58 |
| Complexity | 2891.9292 |
Chemical Identifiers
| CAS Number | 85136-01-2 |
|---|---|
| SMILES | CC\1=CC(=O)C(=C/C1=N/NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N/N=C\4/C(=CC5=C(C4=O)C=CC(=C5N=NC6=CC=CC7=NNN=C76)N)S(=O)(=O)O)OC)OC)C(=O)O |
Product Overview
C38H30N10O9S (CAS 85136-01-2), with molecular formula C38H30N10O9S and molecular weight 802.19 g/mol. IUPAC: (3Z)-3-[[4-[4-[(2E)-2-[6-amino-5-(2H-benzotriazol-4-yldiazenyl)-1-oxo-3-sulfonaphthalen-2-ylidene]hydrazinyl]-3-methoxyphenyl]-2-methoxyphenyl]hydrazinylidene]-4-methyl-6-oxocyclohexa-1,4-diene-1-carboxylic acid.
Chemical Property Profile of C38H30N10O9S
Property Insights of C38H30N10O9S
The XLogP value of 5.8407 indicates that C38H30N10O9S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 285.36 Ų indicates high polarity, suggesting C38H30N10O9S may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C38H30N10O9S has 6 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C38H30N10O9S?
The CAS number of C38H30N10O9S is 85136-01-2.
What is the molecular formula of C38H30N10O9S?
The molecular formula of C38H30N10O9S is C38H30N10O9S.
What is the molecular weight of C38H30N10O9S?
The molecular weight of C38H30N10O9S is 802.19 g/mol.
Where can I buy C38H30N10O9S?
You can request a quote for C38H30N10O9S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C38H30N10O9S?
Yes, KEHONG BIO provides custom synthesis services for C38H30N10O9S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.