UPCMLD0ENAT5834970:001
TL;DR: UPCMLD0ENAT5834970:001 (CAS 838898-65-0) is a chemical compound with molecular formula C24H33N7O3 and molecular weight 467.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-7-(2-morpholin-4-ylethyl)-8-[(4-phenylpiperazin-1-yl)methyl]purine-2,6-dione
Also Known As: UPCMLD0ENAT5834970:001, 1,3-dimethyl-7-(2-morpholin-4-ylethyl)-8-[(4-phenylpiperazin-1-yl)methyl]purine-2,6-dione, 1,3-dimethyl-7-[2-(morpholin-4-yl)ethyl]-8-[(4-phenylpiperazin-1-yl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 1,3-dimethyl-7-(2-morpholin-4-ylethyl)-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione, 1,3-dimethyl-7-(2-morpholin-4-ylethyl)-8-[(4-phenylpiperazinyl)methyl]-1,3,7-t rihydropurine-2,6-dione
| Molecular Formula | C24H33N7O3 |
|---|---|
| Molecular Weight | 467.26 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 467.2645 |
| Heavy Atoms | 34 |
| Complexity | 719.0 |
Chemical Identifiers
| CAS Number | 838898-65-0 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=CC=C4)CCN5CCOCC5 |
| InChIKey | WHKRFCMSRHWNGW-UHFFFAOYSA-N |
Product Overview
UPCMLD0ENAT5834970:001 (CAS 838898-65-0), with molecular formula C24H33N7O3 and molecular weight 467.26 g/mol. IUPAC: 1,3-dimethyl-7-(2-morpholin-4-ylethyl)-8-[(4-phenylpiperazin-1-yl)methyl]purine-2,6-dione.
Chemical Property Profile of UPCMLD0ENAT5834970:001
Property Insights of UPCMLD0ENAT5834970:001
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5834970:001. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5834970:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5834970:001 has 0 hydrogen bond donor(s) and 7 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 UPCMLD0ENAT5834970:001?
The CAS number of UPCMLD0ENAT5834970:001 is 838898-65-0.
What is the molecular formula of UPCMLD0ENAT5834970:001?
The molecular formula of UPCMLD0ENAT5834970:001 is C24H33N7O3.
What is the molecular weight of UPCMLD0ENAT5834970:001?
The molecular weight of UPCMLD0ENAT5834970:001 is 467.26 g/mol.
Where can I buy UPCMLD0ENAT5834970:001?
You can request a quote for UPCMLD0ENAT5834970:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5834970:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5834970:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.