AB00121853-01
TL;DR: AB00121853-01 (CAS 370868-75-0) is a chemical compound with molecular formula C22H19N3O5 and molecular weight 405.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-(furan-2-ylmethyl)-5-[[1-(4-hydroxyphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: AB00121853-01, (5E)-1-(furan-2-ylmethyl)-5-[[1-(4-hydroxyphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione, (E)-1-(furan-2-ylmethyl)-5-((1-(4-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-(2-furylmethyl)-5-{[1-(4-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione, (5E)-3-(furan-2-ylmethyl)-6-hydroxy-5-{[1-(4-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C22H19N3O5 |
|---|---|
| Molecular Weight | 405.13 g/mol |
| LogP | 3.05474 |
| Topological Polar Surface Area | 104.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.13248 |
| Heavy Atoms | 30 |
| Complexity | 1170.336 |
Chemical Identifiers
| CAS Number | 370868-75-0 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)O)C)/C=C/3\C(=O)NC(=O)N(C3=O)CC4=CC=CO4 |
Product Overview
AB00121853-01 (CAS 370868-75-0), with molecular formula C22H19N3O5 and molecular weight 405.13 g/mol. IUPAC: (5E)-1-(furan-2-ylmethyl)-5-[[1-(4-hydroxyphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of AB00121853-01
Property Insights of AB00121853-01
The XLogP value of 3.05474 indicates that AB00121853-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.78 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00121853-01. Following Lipinski's Rule of Five, AB00121853-01 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 AB00121853-01?
The CAS number of AB00121853-01 is 370868-75-0.
What is the molecular formula of AB00121853-01?
The molecular formula of AB00121853-01 is C22H19N3O5.
What is the molecular weight of AB00121853-01?
The molecular weight of AB00121853-01 is 405.13 g/mol.
Where can I buy AB00121853-01?
You can request a quote for AB00121853-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00121853-01?
Yes, KEHONG BIO provides custom synthesis services for AB00121853-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.