Cambridge id 6784781
TL;DR: Cambridge id 6784781 (CAS 98863-05-9) is a chemical compound with molecular formula C19H17N3O4 and molecular weight 351.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,3-benzodioxole-5-carboxamide
Also Known As: BAS 03450391, AN-652/13028191, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1,3-benzodioxole-5-carboxamide, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,3-benzodioxole-5-carboxamide, N-(1,5-DIMETHYL-3-OXO-2-PHENYLPYRAZOL-4-YL)-2H-1,3-BENZODIOXOLE-5-CARBOXAMIDE
| Molecular Formula | C19H17N3O4 |
|---|---|
| Molecular Weight | 351.12 g/mol |
| LogP | 2.46542 |
| Topological Polar Surface Area | 74.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.12192 |
| Heavy Atoms | 26 |
| Complexity | 1050.6365 |
Chemical Identifiers
| CAS Number | 98863-05-9 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)OCO4 |
Product Overview
Cambridge id 6784781 (CAS 98863-05-9), with molecular formula C19H17N3O4 and molecular weight 351.12 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of Cambridge id 6784781
Property Insights of Cambridge id 6784781
The XLogP value of 2.46542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cambridge id 6784781. The TPSA of 74.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 6784781. Following Lipinski's Rule of Five, Cambridge id 6784781 has 1 hydrogen bond donor(s) and 4 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 Cambridge id 6784781?
The CAS number of Cambridge id 6784781 is 98863-05-9.
What is the molecular formula of Cambridge id 6784781?
The molecular formula of Cambridge id 6784781 is C19H17N3O4.
What is the molecular weight of Cambridge id 6784781?
The molecular weight of Cambridge id 6784781 is 351.12 g/mol.
Where can I buy Cambridge id 6784781?
You can request a quote for Cambridge id 6784781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 6784781?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 6784781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.