ZERO/001445
TL;DR: ZERO/001445 (CAS 159587-53-8) is a chemical compound with molecular formula C14H14N2O5 and molecular weight 290.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: ZERO/001445, BAS 00381421, J1.928.771H, methyl 4-(2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, Methyl 4-(benzo[d][1,3]dioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C14H14N2O5 |
|---|---|
| Molecular Weight | 290.09 g/mol |
| LogP | 1.2162 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.09027 |
| Heavy Atoms | 21 |
| Complexity | 652.76447 |
Chemical Identifiers
| CAS Number | 159587-53-8 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC3=C(C=C2)OCO3)C(=O)OC |
Product Overview
ZERO/001445 (CAS 159587-53-8), with molecular formula C14H14N2O5 and molecular weight 290.09 g/mol. IUPAC: methyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of ZERO/001445
Property Insights of ZERO/001445
The XLogP value of 1.2162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ZERO/001445. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for ZERO/001445. Following Lipinski's Rule of Five, ZERO/001445 has 2 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 ZERO/001445?
The CAS number of ZERO/001445 is 159587-53-8.
What is the molecular formula of ZERO/001445?
The molecular formula of ZERO/001445 is C14H14N2O5.
What is the molecular weight of ZERO/001445?
The molecular weight of ZERO/001445 is 290.09 g/mol.
Where can I buy ZERO/001445?
You can request a quote for ZERO/001445 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ZERO/001445?
Yes, KEHONG BIO provides custom synthesis services for ZERO/001445 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.