TimTec1_006284
TL;DR: TimTec1_006284 (CAS 695192-87-1) is a chemical compound with molecular formula C21H21N3O2 and molecular weight 347.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-phenyl-6-(2-phenylethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Also Known As: TimTec1_006284, 1-Methyl-6-phenethyl-4-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione, 1-methyl-4-phenyl-6-(2-phenylethyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione, A3301/0140273, 1-methyl-4-phenyl-6-(2-phenylethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione
| Molecular Formula | C21H21N3O2 |
|---|---|
| Molecular Weight | 347.16 g/mol |
| LogP | 2.7217 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.1634 |
| Heavy Atoms | 26 |
| Complexity | 861.33966 |
Chemical Identifiers
| CAS Number | 695192-87-1 |
|---|---|
| SMILES | CN1C2=C(C(NC1=O)C3=CC=CC=C3)C(=O)N(C2)CCC4=CC=CC=C4 |
Product Overview
TimTec1_006284 (CAS 695192-87-1), with molecular formula C21H21N3O2 and molecular weight 347.16 g/mol. IUPAC: 1-methyl-4-phenyl-6-(2-phenylethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione.
Chemical Property Profile of TimTec1_006284
Property Insights of TimTec1_006284
The XLogP value of 2.7217 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_006284. With a topological polar surface area (TPSA) of 52.65 Ų, TimTec1_006284 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_006284 has 1 hydrogen bond donor(s) and 2 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 TimTec1_006284?
The CAS number of TimTec1_006284 is 695192-87-1.
What is the molecular formula of TimTec1_006284?
The molecular formula of TimTec1_006284 is C21H21N3O2.
What is the molecular weight of TimTec1_006284?
The molecular weight of TimTec1_006284 is 347.16 g/mol.
Where can I buy TimTec1_006284?
You can request a quote for TimTec1_006284 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_006284?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_006284 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.