UPCMLD0ENAT5874272:001
TL;DR: UPCMLD0ENAT5874272:001 (CAS 878735-67-2) is a chemical compound with molecular formula C18H17Cl2N5O2 and molecular weight 405.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(3,4-dichlorophenyl)methyl]-2,4,7,8-tetramethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: UPCMLD0ENAT5874272:001, BAS 13030636, VU0509670-1, F3124-1058, 6-[(3,4-dichlorophenyl)methyl]-2,4,7,8-tetramethylpurino[7,8-a]imidazole-1,3-dione
| Molecular Formula | C18H17Cl2N5O2 |
|---|---|
| Molecular Weight | 405.08 g/mol |
| LogP | 2.65834 |
| Topological Polar Surface Area | 66.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 405.07593 |
| Heavy Atoms | 27 |
| Complexity | 1356.8187 |
Chemical Identifiers
| CAS Number | 878735-67-2 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CC4=CC(=C(C=C4)Cl)Cl)N(C(=O)N(C3=O)C)C)C |
Product Overview
UPCMLD0ENAT5874272:001 (CAS 878735-67-2), with molecular formula C18H17Cl2N5O2 and molecular weight 405.08 g/mol. IUPAC: 6-[(3,4-dichlorophenyl)methyl]-2,4,7,8-tetramethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of UPCMLD0ENAT5874272:001
Property Insights of UPCMLD0ENAT5874272:001
The XLogP value of 2.65834 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5874272:001. The TPSA of 66.23 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5874272:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5874272:001 has 0 hydrogen bond donor(s) and 3 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 UPCMLD0ENAT5874272:001?
The CAS number of UPCMLD0ENAT5874272:001 is 878735-67-2.
What is the molecular formula of UPCMLD0ENAT5874272:001?
The molecular formula of UPCMLD0ENAT5874272:001 is C18H17Cl2N5O2.
What is the molecular weight of UPCMLD0ENAT5874272:001?
The molecular weight of UPCMLD0ENAT5874272:001 is 405.08 g/mol.
Where can I buy UPCMLD0ENAT5874272:001?
You can request a quote for UPCMLD0ENAT5874272:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5874272:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5874272:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.