BAS 00513068
TL;DR: BAS 00513068 (CAS 345615-03-4) is a chemical compound with molecular formula C19H22Cl2N6O2 and molecular weight 436.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(2,4-dichlorophenyl)methylideneamino]-2,6-dimorpholin-4-ylpyrimidin-4-amine
Also Known As: BAS 00513068, BIM-0022484.P001, N-[(E)-(2,4-dichlorophenyl)methylideneamino]-2,6-dimorpholin-4-ylpyrimidin-4-amine, 2,4-dichlorobenzaldehyde [2,6-di(4-morpholinyl)-4-pyrimidinyl]hydrazone, [(1E)-2-(2,4-dichlorophenyl)-1-azavinyl](2,6-dimorpholin-4-ylpyrimidin-4-yl)am ine
| Molecular Formula | C19H22Cl2N6O2 |
|---|---|
| Molecular Weight | 436.12 g/mol |
| LogP | 2.9026 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 436.11813 |
| Heavy Atoms | 29 |
| Complexity | 833.523 |
Chemical Identifiers
| CAS Number | 345615-03-4 |
|---|---|
| SMILES | C1COCCN1C2=NC(=NC(=C2)N/N=C/C3=C(C=C(C=C3)Cl)Cl)N4CCOCC4 |
Product Overview
BAS 00513068 (CAS 345615-03-4), with molecular formula C19H22Cl2N6O2 and molecular weight 436.12 g/mol. IUPAC: N-[(E)-(2,4-dichlorophenyl)methylideneamino]-2,6-dimorpholin-4-ylpyrimidin-4-amine.
Chemical Property Profile of BAS 00513068
Property Insights of BAS 00513068
The XLogP value of 2.9026 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00513068. The TPSA of 75.11 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00513068. Following Lipinski's Rule of Five, BAS 00513068 has 1 hydrogen bond donor(s) and 8 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 BAS 00513068?
The CAS number of BAS 00513068 is 345615-03-4.
What is the molecular formula of BAS 00513068?
The molecular formula of BAS 00513068 is C19H22Cl2N6O2.
What is the molecular weight of BAS 00513068?
The molecular weight of BAS 00513068 is 436.12 g/mol.
Where can I buy BAS 00513068?
You can request a quote for BAS 00513068 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00513068?
Yes, KEHONG BIO provides custom synthesis services for BAS 00513068 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.