RefChem:1097517
TL;DR: RefChem:1097517 (CAS 57513-77-6) is a chemical compound with molecular formula C11H13Cl3N4 and molecular weight 306.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride
Also Known As: OT 24, anti-2-(2,6-Dichlorobenzylidenehydrazino)-3,4,5,6-tetrahydropyrimidine hydrochloride, Pyrimidine, 3,4,5,6-tetrahydro-2-(2,6-dichlorobenzylidenehydrazino)-, hydrochloride, (anti)-, Pyrimidine, 2-(2,6-dichlorobenzylidenehydrazino)-3,4,5,6-tetrahydro-, hydrochloride, (anti)-, Benzaldehyde, 2,6-dichloro-, (1,4,5,6-tetrahydro-2-pyrimidinyl)hydrazone, monohydrochloride, (Z)-
| Molecular Formula | C11H13Cl3N4 |
|---|---|
| Molecular Weight | 306.02 g/mol |
| LogP | 2.688 |
| Topological Polar Surface Area | 48.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.02057 |
| Heavy Atoms | 18 |
| Complexity | 439.3516 |
Chemical Identifiers
| CAS Number | 57513-77-6 |
|---|---|
| SMILES | C1CNC(=NC1)N/N=C\C2=C(C=CC=C2Cl)Cl.Cl |
Product Overview
RefChem:1097517 (CAS 57513-77-6), with molecular formula C11H13Cl3N4 and molecular weight 306.02 g/mol. IUPAC: N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride.
Chemical Property Profile of RefChem:1097517
Property Insights of RefChem:1097517
The XLogP value of 2.688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1097517. With a topological polar surface area (TPSA) of 48.78 Ų, RefChem:1097517 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1097517 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 RefChem:1097517?
The CAS number of RefChem:1097517 is 57513-77-6.
What is the molecular formula of RefChem:1097517?
The molecular formula of RefChem:1097517 is C11H13Cl3N4.
What is the molecular weight of RefChem:1097517?
The molecular weight of RefChem:1097517 is 306.02 g/mol.
Where can I buy RefChem:1097517?
You can request a quote for RefChem:1097517 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1097517?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1097517 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.