UPCMLD0ENAT5876192:001
TL;DR: UPCMLD0ENAT5876192:001 (CAS 887863-58-3) is a chemical compound with molecular formula C23H23N5O2 and molecular weight 401.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-4-methyl-6-[(4-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
Also Known As: UPCMLD0ENAT5876192:001, F2582-0003, 2-benzyl-4-methyl-6-[(4-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione, 3-benzyl-1-methyl-8-[(4-methylphenyl)methyl]-1H,2H,3H,4H,6H,7H,8H-imidazo[1,2-g]purine-2,4-dione, 1-methyl-8-[(4-methylphenyl)methyl]-3-benzyl-1,3,5-trihydroimidazolidino[1,2-h ]purine-2,4-dione
| Molecular Formula | C23H23N5O2 |
|---|---|
| Molecular Weight | 401.19 g/mol |
| LogP | 2.27362 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.18518 |
| Heavy Atoms | 30 |
| Complexity | 1347.1104 |
Chemical Identifiers
| CAS Number | 887863-58-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=CC=CC=C5 |
Product Overview
UPCMLD0ENAT5876192:001 (CAS 887863-58-3), with molecular formula C23H23N5O2 and molecular weight 401.19 g/mol. IUPAC: 2-benzyl-4-methyl-6-[(4-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of UPCMLD0ENAT5876192:001
Property Insights of UPCMLD0ENAT5876192:001
The XLogP value of 2.27362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5876192:001. The TPSA of 65.06 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5876192:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5876192:001 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 UPCMLD0ENAT5876192:001?
The CAS number of UPCMLD0ENAT5876192:001 is 887863-58-3.
What is the molecular formula of UPCMLD0ENAT5876192:001?
The molecular formula of UPCMLD0ENAT5876192:001 is C23H23N5O2.
What is the molecular weight of UPCMLD0ENAT5876192:001?
The molecular weight of UPCMLD0ENAT5876192:001 is 401.19 g/mol.
Where can I buy UPCMLD0ENAT5876192:001?
You can request a quote for UPCMLD0ENAT5876192:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5876192:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5876192:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.