UPCMLD0ENAT5732053:001
TL;DR: UPCMLD0ENAT5732053:001 (CAS 372171-54-5) is a chemical compound with molecular formula C17H19N5O3 and molecular weight 341.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(4-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropurino[7,8-a][1,3]diazepine-2,4-dione
Also Known As: UPCMLD0ENAT5732053:001, BAS 00288281, 10-(4-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropurino[7,8-a][1,3]diazepine-2,4-dione, 10-(4-methoxyphenyl)-1-methyl-1,3,5-trihydro-6H,7H,8H,9H-1,3-diazaperhydroepin o[1,2-h]purine-2,4-dione, 10-(4-methoxyphenyl)-1-methyl-1H,2H,3H,4H,6H,7H,8H,9H,10H-[1,3]diazepino[1,2-g]purine-2,4-dione
| Molecular Formula | C17H19N5O3 |
|---|---|
| Molecular Weight | 341.15 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 79.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.1488 |
| Heavy Atoms | 25 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 372171-54-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N3CCCCN(C3=N2)C4=CC=C(C=C4)OC |
| InChIKey | ZTNIYCDRVPTXFP-UHFFFAOYSA-N |
Product Overview
UPCMLD0ENAT5732053:001 (CAS 372171-54-5), with molecular formula C17H19N5O3 and molecular weight 341.15 g/mol. IUPAC: 10-(4-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropurino[7,8-a][1,3]diazepine-2,4-dione.
Chemical Property Profile of UPCMLD0ENAT5732053:001
Property Insights of UPCMLD0ENAT5732053:001
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5732053:001. The TPSA of 79.7 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5732053:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5732053:001 has 1 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 UPCMLD0ENAT5732053:001?
The CAS number of UPCMLD0ENAT5732053:001 is 372171-54-5.
What is the molecular formula of UPCMLD0ENAT5732053:001?
The molecular formula of UPCMLD0ENAT5732053:001 is C17H19N5O3.
What is the molecular weight of UPCMLD0ENAT5732053:001?
The molecular weight of UPCMLD0ENAT5732053:001 is 341.15 g/mol.
Where can I buy UPCMLD0ENAT5732053:001?
You can request a quote for UPCMLD0ENAT5732053:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5732053:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5732053:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.