UPCMLD0ENAT5731925:001
TL;DR: UPCMLD0ENAT5731925:001 (CAS 887696-22-2) is a chemical compound with molecular formula C21H27N5O4 and molecular weight 413.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyethyl)-9-(2-methoxy-5-methylphenyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: UPCMLD0ENAT5731925:001, BAS 13765341, VU0492764-1, F3164-0258, 3-(2-methoxyethyl)-9-(2-methoxy-5-methylphenyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
| Molecular Formula | C21H27N5O4 |
|---|---|
| Molecular Weight | 413.21 g/mol |
| LogP | 1.64792 |
| Topological Polar Surface Area | 83.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.2063 |
| Heavy Atoms | 30 |
| Complexity | 1222.8304 |
Chemical Identifiers
| CAS Number | 887696-22-2 |
|---|---|
| SMILES | CC1CN(C2=NC3=C(N2C1)C(=O)N(C(=O)N3C)CCOC)C4=C(C=CC(=C4)C)OC |
Product Overview
UPCMLD0ENAT5731925:001 (CAS 887696-22-2), with molecular formula C21H27N5O4 and molecular weight 413.21 g/mol. IUPAC: 3-(2-methoxyethyl)-9-(2-methoxy-5-methylphenyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.
Chemical Property Profile of UPCMLD0ENAT5731925:001
Property Insights of UPCMLD0ENAT5731925:001
The XLogP value of 1.64792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5731925:001. The TPSA of 83.52 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5731925:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5731925:001 has 0 hydrogen bond donor(s) and 6 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 UPCMLD0ENAT5731925:001?
The CAS number of UPCMLD0ENAT5731925:001 is 887696-22-2.
What is the molecular formula of UPCMLD0ENAT5731925:001?
The molecular formula of UPCMLD0ENAT5731925:001 is C21H27N5O4.
What is the molecular weight of UPCMLD0ENAT5731925:001?
The molecular weight of UPCMLD0ENAT5731925:001 is 413.21 g/mol.
Where can I buy UPCMLD0ENAT5731925:001?
You can request a quote for UPCMLD0ENAT5731925:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5731925:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5731925:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.