UPCMLD0ENAT5783511:001
TL;DR: UPCMLD0ENAT5783511:001 (CAS 893972-08-2) is a chemical compound with molecular formula C19H29N5O3 and molecular weight 375.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2-ethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-(3-oxobutan-2-yl)purine-2,6-dione
Also Known As: UPCMLD0ENAT5783511:001, 8-[(2-ethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-(3-oxobutan-2-yl)purine-2,6-dione, 8-[(2-ethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-(3-oxobutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione, 8-[(2-ethyl-1-piperidyl)methyl]-1,3-dimethyl-7-(3-oxobutan-2-yl)purine-2,6-dione, 8-((2-ethylpiperidin-1-yl)methyl)-1,3-dimethyl-7-(3-oxobutan-2-yl)-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C19H29N5O3 |
|---|---|
| Molecular Weight | 375.23 g/mol |
| LogP | 1.3482 |
| Topological Polar Surface Area | 82.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.22705 |
| Heavy Atoms | 27 |
| Complexity | 983.8623 |
Chemical Identifiers
| CAS Number | 893972-08-2 |
|---|---|
| SMILES | CCC1CCCCN1CC2=NC3=C(N2C(C)C(=O)C)C(=O)N(C(=O)N3C)C |
Product Overview
UPCMLD0ENAT5783511:001 (CAS 893972-08-2), with molecular formula C19H29N5O3 and molecular weight 375.23 g/mol. IUPAC: 8-[(2-ethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-(3-oxobutan-2-yl)purine-2,6-dione.
Chemical Property Profile of UPCMLD0ENAT5783511:001
Property Insights of UPCMLD0ENAT5783511:001
The XLogP value of 1.3482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5783511:001. The TPSA of 82.13 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5783511:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5783511:001 has 0 hydrogen bond donor(s) and 5 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 UPCMLD0ENAT5783511:001?
The CAS number of UPCMLD0ENAT5783511:001 is 893972-08-2.
What is the molecular formula of UPCMLD0ENAT5783511:001?
The molecular formula of UPCMLD0ENAT5783511:001 is C19H29N5O3.
What is the molecular weight of UPCMLD0ENAT5783511:001?
The molecular weight of UPCMLD0ENAT5783511:001 is 375.23 g/mol.
Where can I buy UPCMLD0ENAT5783511:001?
You can request a quote for UPCMLD0ENAT5783511:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5783511:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5783511:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.