1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm
TL;DR: 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm (CAS 81727-99-3) is a chemical compound with molecular formula C15H14Cl2N4O and molecular weight 336.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[(3,5-dichloro-4-hydroxyphenyl)-phenylmethylidene]amino]-2-methylguanidine
Also Known As: 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm, Hydrazinecarboximidamide, 2-[(3,5-dichloro-4-hydroxy-phenyl)phenylmethylene]-n-methyl-
| Molecular Formula | C15H14Cl2N4O |
|---|---|
| Molecular Weight | 336.05 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 83.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.05447 |
| Heavy Atoms | 22 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 81727-99-3 |
|---|---|
| SMILES | CN=C(N)NN=C(C1=CC=CC=C1)C2=CC(=C(C(=C2)Cl)O)Cl |
| InChIKey | IIEKXKINQSSBBF-UHFFFAOYSA-N |
Product Overview
1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm (CAS 81727-99-3), with molecular formula C15H14Cl2N4O and molecular weight 336.05 g/mol. IUPAC: 1-[[(3,5-dichloro-4-hydroxyphenyl)-phenylmethylidene]amino]-2-methylguanidine.
Chemical Property Profile of 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm
Property Insights of 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm
The XLogP value of 3.6 indicates that 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm. Following Lipinski's Rule of Five, 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm 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 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm?
The CAS number of 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm is 81727-99-3.
What is the molecular formula of 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm?
The molecular formula of 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm is C15H14Cl2N4O.
What is the molecular weight of 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm?
The molecular weight of 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm is 336.05 g/mol.
Where can I buy 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm?
You can request a quote for 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm?
Yes, KEHONG BIO provides custom synthesis services for 1-[[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylm and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.