RefChem:245626
TL;DR: RefChem:245626 (CAS 1037-97-4) is a chemical compound with molecular formula C15H20ClN3O4 and molecular weight 341.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(dimethylamino)ethyl]-5-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione;hydrochloride
Also Known As: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2-(dimethylamino)ethyl)-5-(3-methoxyphenyl)-, monohydrochloride, 5-(2-dimethylaminoethyl)-5-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione Hydrochloride, 5-[2-(dimethylamino)ethyl]-5-(3-methoxyphenyl)pyrimidine-2,4,6(1h,3h,5h)-trione hydrochloride(1:1), 5-[2-(Dimethylamino)ethyl]-5-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione--hydrogen chloride (1/1), RefChem:245626
| Molecular Formula | C15H20ClN3O4 |
|---|---|
| Molecular Weight | 341.11 g/mol |
| LogP | 0.67 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.11423 |
| Heavy Atoms | 23 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 1037-97-4 |
|---|---|
| SMILES | CN(C)CCC1(C(=O)NC(=O)NC1=O)C2=CC(=CC=C2)OC.Cl |
| InChIKey | ZJTIUGGEZMDIEE-UHFFFAOYSA-N |
Product Overview
RefChem:245626 (CAS 1037-97-4), with molecular formula C15H20ClN3O4 and molecular weight 341.11 g/mol. IUPAC: 5-[2-(dimethylamino)ethyl]-5-(3-methoxyphenyl)-1,3-diazinane-2,4,6-trione;hydrochloride.
Chemical Property Profile of RefChem:245626
Property Insights of RefChem:245626
The XLogP value of 0.67 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:245626. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:245626. Following Lipinski's Rule of Five, RefChem:245626 has 3 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:245626?
The CAS number of RefChem:245626 is 1037-97-4.
What is the molecular formula of RefChem:245626?
The molecular formula of RefChem:245626 is C15H20ClN3O4.
What is the molecular weight of RefChem:245626?
The molecular weight of RefChem:245626 is 341.11 g/mol.
Where can I buy RefChem:245626?
You can request a quote for RefChem:245626 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:245626?
Yes, KEHONG BIO provides custom synthesis services for RefChem:245626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.