Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-
TL;DR: Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)- (CAS 130974-87-7) is a chemical compound with molecular formula C11H12ClN3O3 and molecular weight 269.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[N'-(4-chlorophenyl)carbamimidoyl]amino] 3-oxobutanoate
Also Known As: Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-, [[N'-(4-chlorophenyl)carbamimidoyl]amino] 3-oxobutanoate, N''-(4-Chlorophenyl)-N-[(3-oxobutanoyl)oxy]guanidine
| Molecular Formula | C11H12ClN3O3 |
|---|---|
| Molecular Weight | 269.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.05673 |
| Heavy Atoms | 18 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 130974-87-7 |
|---|---|
| SMILES | CC(=O)CC(=O)ONC(=NC1=CC=C(C=C1)Cl)N |
| InChIKey | HKGVJUDRICUACM-UHFFFAOYSA-N |
Product Overview
Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)- (CAS 130974-87-7), with molecular formula C11H12ClN3O3 and molecular weight 269.06 g/mol. IUPAC: [[N'-(4-chlorophenyl)carbamimidoyl]amino] 3-oxobutanoate.
Chemical Property Profile of Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-
Property Insights of Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-. Following Lipinski's Rule of Five, Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)- has 2 hydrogen bond donor(s) and 4 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-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-?
The CAS number of Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)- is 130974-87-7.
What is the molecular formula of Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-?
The molecular formula of Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)- is C11H12ClN3O3.
What is the molecular weight of Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-?
The molecular weight of Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)- is 269.06 g/mol.
Where can I buy Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-?
You can request a quote for Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, N-(4-chlorophenyl)-N'-(1,3-dioxobutoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.