UPCMLD0ENAT5832967:001
TL;DR: UPCMLD0ENAT5832967:001 (CAS 378198-65-3) is a chemical compound with molecular formula C24H27N5O2 and molecular weight 417.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[benzyl(methyl)amino]-1,3-dimethyl-7-(3-phenylpropyl)purine-2,6-dione
Also Known As: UPCMLD0ENAT5832967:001, 8-(benzyl(methyl)amino)-1,3-dimethyl-7-(3-phenylpropyl)-1H-purine-2,6(3H,7H)-dione, 8-[benzyl(methyl)amino]-1,3-dimethyl-7-(3-phenylpropyl)purine-2,6-dione, 8-[benzyl(methyl)amino]-1,3-dimethyl-7-(3-phenylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 1,3-dimethyl-8-[methylbenzylamino]-7-(3-phenylpropyl)-1,3,7-trihydropurine-2,6 -dione
| Molecular Formula | C24H27N5O2 |
|---|---|
| Molecular Weight | 417.22 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 61.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.21646 |
| Heavy Atoms | 31 |
| Complexity | 631.0 |
Chemical Identifiers
| CAS Number | 378198-65-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N(C)CC3=CC=CC=C3)CCCC4=CC=CC=C4 |
| InChIKey | SCZDJTJZWWSZSL-UHFFFAOYSA-N |
Product Overview
UPCMLD0ENAT5832967:001 (CAS 378198-65-3), with molecular formula C24H27N5O2 and molecular weight 417.22 g/mol. IUPAC: 8-[benzyl(methyl)amino]-1,3-dimethyl-7-(3-phenylpropyl)purine-2,6-dione.
Chemical Property Profile of UPCMLD0ENAT5832967:001
Property Insights of UPCMLD0ENAT5832967:001
The XLogP value of 3.8 indicates that UPCMLD0ENAT5832967:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5832967:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5832967:001 has 0 hydrogen bond donor(s) and 4 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 UPCMLD0ENAT5832967:001?
The CAS number of UPCMLD0ENAT5832967:001 is 378198-65-3.
What is the molecular formula of UPCMLD0ENAT5832967:001?
The molecular formula of UPCMLD0ENAT5832967:001 is C24H27N5O2.
What is the molecular weight of UPCMLD0ENAT5832967:001?
The molecular weight of UPCMLD0ENAT5832967:001 is 417.22 g/mol.
Where can I buy UPCMLD0ENAT5832967:001?
You can request a quote for UPCMLD0ENAT5832967:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5832967:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5832967:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.