AB00733735-01
TL;DR: AB00733735-01 (CAS 854349-01-2) is a chemical compound with molecular formula C22H30N4O4 and molecular weight 414.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-(3-methoxypropyl)cyclohexanecarboxamide
Also Known As: AB00733735-01, N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-(3-methoxypropyl)cyclohexanecarboxamide, N-(6-amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-N-(3-methoxypropyl)cyclohexanecarboxamide
| Molecular Formula | C22H30N4O4 |
|---|---|
| Molecular Weight | 414.23 g/mol |
| LogP | 2.1169 |
| Topological Polar Surface Area | 110.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 414.2267 |
| Heavy Atoms | 30 |
| Complexity | 961.3382 |
Chemical Identifiers
| CAS Number | 854349-01-2 |
|---|---|
| SMILES | COCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3CCCCC3 |
Product Overview
AB00733735-01 (CAS 854349-01-2), with molecular formula C22H30N4O4 and molecular weight 414.23 g/mol. IUPAC: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-(3-methoxypropyl)cyclohexanecarboxamide.
Chemical Property Profile of AB00733735-01
Property Insights of AB00733735-01
The XLogP value of 2.1169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00733735-01. The TPSA of 110.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00733735-01. Following Lipinski's Rule of Five, AB00733735-01 has 2 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 AB00733735-01?
The CAS number of AB00733735-01 is 854349-01-2.
What is the molecular formula of AB00733735-01?
The molecular formula of AB00733735-01 is C22H30N4O4.
What is the molecular weight of AB00733735-01?
The molecular weight of AB00733735-01 is 414.23 g/mol.
Where can I buy AB00733735-01?
You can request a quote for AB00733735-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00733735-01?
Yes, KEHONG BIO provides custom synthesis services for AB00733735-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.