ChemDiv1_028383
TL;DR: ChemDiv1_028383 (CAS 496923-35-4) is a chemical compound with molecular formula C20H18N2O5 and molecular weight 366.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxyphenyl)-3-methyl-4,6-dioxo-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid
Also Known As: ChemDiv1_028383, MixCom6_000575, ZERO/001901, 3-(2-hydroxyphenyl)-1-methyl-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid, 1-(2-hydroxyphenyl)-3-methyl-4,6-dioxo-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid
| Molecular Formula | C20H18N2O5 |
|---|---|
| Molecular Weight | 366.12 g/mol |
| LogP | 1.6856 |
| Topological Polar Surface Area | 106.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.12158 |
| Heavy Atoms | 27 |
| Complexity | 944.3981 |
Chemical Identifiers
| CAS Number | 496923-35-4 |
|---|---|
| SMILES | CC1(C2C(C(N1)C3=CC=CC=C3O)C(=O)N(C2=O)C4=CC=CC=C4)C(=O)O |
Product Overview
ChemDiv1_028383 (CAS 496923-35-4), with molecular formula C20H18N2O5 and molecular weight 366.12 g/mol. IUPAC: 1-(2-hydroxyphenyl)-3-methyl-4,6-dioxo-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid.
Chemical Property Profile of ChemDiv1_028383
Property Insights of ChemDiv1_028383
The XLogP value of 1.6856 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_028383. The TPSA of 106.94 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_028383. Following Lipinski's Rule of Five, ChemDiv1_028383 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 ChemDiv1_028383?
The CAS number of ChemDiv1_028383 is 496923-35-4.
What is the molecular formula of ChemDiv1_028383?
The molecular formula of ChemDiv1_028383 is C20H18N2O5.
What is the molecular weight of ChemDiv1_028383?
The molecular weight of ChemDiv1_028383 is 366.12 g/mol.
Where can I buy ChemDiv1_028383?
You can request a quote for ChemDiv1_028383 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_028383?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_028383 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.