Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)-
TL;DR: Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- (CAS 57004-87-2) is a chemical compound with molecular formula C10H13Cl2N3 and molecular weight 245.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)-2-propan-2-ylguanidine
Also Known As: Bayer 80283, methyl-3 phenyl-1 heptanone-1, N-(3,4-Dichlorophenyl)-N'-(1-methylethyl)guanidine, GUANIDINE, N-(3,4-DICHLOROPHENYL)-N'-(1-METHYLETHYL)-, 1-(3,4-dichlorophenyl)-2-propan-2-ylguanidine
| Molecular Formula | C10H13Cl2N3 |
|---|---|
| Molecular Weight | 245.05 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.04866 |
| Heavy Atoms | 15 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 57004-87-2 |
|---|---|
| SMILES | CC(C)N=C(N)NC1=CC(=C(C=C1)Cl)Cl |
| InChIKey | NOLBMHUJUOIAFK-UHFFFAOYSA-N |
Product Overview
Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- (CAS 57004-87-2), with molecular formula C10H13Cl2N3 and molecular weight 245.05 g/mol. IUPAC: 1-(3,4-dichlorophenyl)-2-propan-2-ylguanidine.
Chemical Property Profile of Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)-
Property Insights of Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)-
The XLogP value of 3.5 indicates that Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.4 Ų, Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- has 2 hydrogen bond donor(s) and 1 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 Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)-?
The CAS number of Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- is 57004-87-2.
What is the molecular formula of Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)-?
The molecular formula of Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- is C10H13Cl2N3.
What is the molecular weight of Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)-?
The molecular weight of Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- is 245.05 g/mol.
Where can I buy Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)-?
You can request a quote for Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, N-(3,4-dichlorophenyl)-N'-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.