![4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol structure](/static/products/328/328023-51-4.png)
4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol
TL;DR: 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol (CAS 328023-51-4) is a chemical compound with molecular formula C14H13N3O4 and molecular weight 287.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol
Also Known As: 4-[N-(4-nitrophenyl)ethanehydrazonoyl]-1,3-benzenediol, 1-(2,4-dihydroxyphenyl)ethanone {4-nitrophenyl}hydrazone
| Molecular Formula | C14H13N3O4 |
|---|---|
| Molecular Weight | 287.09 g/mol |
| LogP | 2.8421 |
| Topological Polar Surface Area | 107.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.0906 |
| Heavy Atoms | 21 |
| Complexity | 695.86536 |
Chemical Identifiers
| CAS Number | 328023-51-4 |
|---|---|
| SMILES | CC(=NNC1=CC=C(C=C1)[N+](=O)[O-])C2=C(C=C(C=C2)O)O |
Product Overview
4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol (CAS 328023-51-4), with molecular formula C14H13N3O4 and molecular weight 287.09 g/mol. IUPAC: 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol.
Chemical Property Profile of 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol
Property Insights of 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol
The XLogP value of 2.8421 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol. The TPSA of 107.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol. Following Lipinski's Rule of Five, 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol has 3 hydrogen bond donor(s) and 6 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 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol?
The CAS number of 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol is 328023-51-4.
What is the molecular formula of 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol?
The molecular formula of 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol is C14H13N3O4.
What is the molecular weight of 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol?
The molecular weight of 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol is 287.09 g/mol.
Where can I buy 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol?
You can request a quote for 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-[C-methyl-N-(4-nitroanilino)carbonimidoyl]benzene-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.