UPCMLD0ENAT5532805:001
TL;DR: UPCMLD0ENAT5532805:001 (CAS 324070-68-0) is a chemical compound with molecular formula C16H16N2O6 and molecular weight 332.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-acetyl-4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylate
Also Known As: UPCMLD0ENAT5532805:001, BAS 00664326, methyl 3-acetyl-4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, methyl 3-acetyl-4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylate, methyl 3-acetyl-4-(2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C16H16N2O6 |
|---|---|
| Molecular Weight | 332.10 g/mol |
| LogP | 1.4751 |
| Topological Polar Surface Area | 94.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.10083 |
| Heavy Atoms | 24 |
| Complexity | 769.8312 |
Chemical Identifiers
| CAS Number | 324070-68-0 |
|---|---|
| SMILES | CC1=C(C(N(C(=O)N1)C(=O)C)C2=CC3=C(C=C2)OCO3)C(=O)OC |
Product Overview
UPCMLD0ENAT5532805:001 (CAS 324070-68-0), with molecular formula C16H16N2O6 and molecular weight 332.10 g/mol. IUPAC: methyl 3-acetyl-4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,4-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of UPCMLD0ENAT5532805:001
Property Insights of UPCMLD0ENAT5532805:001
The XLogP value of 1.4751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5532805:001. The TPSA of 94.17 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5532805:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5532805:001 has 1 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 UPCMLD0ENAT5532805:001?
The CAS number of UPCMLD0ENAT5532805:001 is 324070-68-0.
What is the molecular formula of UPCMLD0ENAT5532805:001?
The molecular formula of UPCMLD0ENAT5532805:001 is C16H16N2O6.
What is the molecular weight of UPCMLD0ENAT5532805:001?
The molecular weight of UPCMLD0ENAT5532805:001 is 332.10 g/mol.
Where can I buy UPCMLD0ENAT5532805:001?
You can request a quote for UPCMLD0ENAT5532805:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5532805:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5532805:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.