RefChem:1065947
TL;DR: RefChem:1065947 (CAS 67410-47-3) is a chemical compound with molecular formula C12H15ClN3O3P and molecular weight 315.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E)-4-chloro-N-[ethoxy(ethylamino)phosphoryl]oxybenzenecarboximidoyl cyanide
Also Known As: 3,5-Dioxa-6-aza-4-phosphaoct-6-ene-8-nitrile, 7-(4-chlorophenyl)-4-(ethylamino)-, 4-oxide, 7-(4-Chlorophenyl)-4-(ethylamino)-3,5-dioxa-6-aza-4-phosphaoct-6-ene-8-nitrile 4-oxide, RefChem:1065947, BRN 2888738
| Molecular Formula | C12H15ClN3O3P |
|---|---|
| Molecular Weight | 315.05 g/mol |
| LogP | 3.33838 |
| Topological Polar Surface Area | 83.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 315.05396 |
| Heavy Atoms | 20 |
| Complexity | 544.06116 |
Chemical Identifiers
| CAS Number | 67410-47-3 |
|---|---|
| SMILES | CCNP(=O)(OCC)O/N=C(/C#N)\C1=CC=C(C=C1)Cl |
Product Overview
RefChem:1065947 (CAS 67410-47-3), with molecular formula C12H15ClN3O3P and molecular weight 315.05 g/mol. IUPAC: (1E)-4-chloro-N-[ethoxy(ethylamino)phosphoryl]oxybenzenecarboximidoyl cyanide.
Chemical Property Profile of RefChem:1065947
Property Insights of RefChem:1065947
The XLogP value of 3.33838 indicates that RefChem:1065947 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.71 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1065947. Following Lipinski's Rule of Five, RefChem:1065947 has 1 hydrogen bond donor(s) and 5 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 RefChem:1065947?
The CAS number of RefChem:1065947 is 67410-47-3.
What is the molecular formula of RefChem:1065947?
The molecular formula of RefChem:1065947 is C12H15ClN3O3P.
What is the molecular weight of RefChem:1065947?
The molecular weight of RefChem:1065947 is 315.05 g/mol.
Where can I buy RefChem:1065947?
You can request a quote for RefChem:1065947 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1065947?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1065947 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.