UPCMLD0ENAT5732779:001
TL;DR: UPCMLD0ENAT5732779:001 (CAS 893955-92-5) is a chemical compound with molecular formula C16H17N5O2 and molecular weight 311.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3,5-dimethylphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
Also Known As: UPCMLD0ENAT5732779:001, 8-(3,5-dimethylphenyl)-1-methyl-1,3,5-trihydroimidazolidino[1,2-h]purine-2,4-d ione, 6-(3,5-dimethylphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione, 8-(3,5-dimethylphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione, 8-(3,5-dimethylphenyl)-4-hydroxy-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purin-2(6H)-one
| Molecular Formula | C16H17N5O2 |
|---|---|
| Molecular Weight | 311.14 g/mol |
| LogP | 1.19184 |
| Topological Polar Surface Area | 75.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 311.1382 |
| Heavy Atoms | 23 |
| Complexity | 1036.4934 |
Chemical Identifiers
| CAS Number | 893955-92-5 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2CCN3C2=NC4=C3C(=O)NC(=O)N4C)C |
Product Overview
UPCMLD0ENAT5732779:001 (CAS 893955-92-5), with molecular formula C16H17N5O2 and molecular weight 311.14 g/mol. IUPAC: 6-(3,5-dimethylphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of UPCMLD0ENAT5732779:001
Property Insights of UPCMLD0ENAT5732779:001
The XLogP value of 1.19184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5732779:001. The TPSA of 75.92 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5732779:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5732779:001 has 1 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 UPCMLD0ENAT5732779:001?
The CAS number of UPCMLD0ENAT5732779:001 is 893955-92-5.
What is the molecular formula of UPCMLD0ENAT5732779:001?
The molecular formula of UPCMLD0ENAT5732779:001 is C16H17N5O2.
What is the molecular weight of UPCMLD0ENAT5732779:001?
The molecular weight of UPCMLD0ENAT5732779:001 is 311.14 g/mol.
Where can I buy UPCMLD0ENAT5732779:001?
You can request a quote for UPCMLD0ENAT5732779:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5732779:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5732779:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.