N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide
TL;DR: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide (CAS 673490-10-3) is a chemical compound with molecular formula C21H19N5O2S and molecular weight 405.13 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)-2-phthalazin-1-ylsulfanylacetamide
Also Known As: CBKinase1_007164, CBKinase1_019564, BAS 07779024, BRD-K21181857-001-01-0, A3411/0144676
| Molecular Formula | C21H19N5O2S |
|---|---|
| Molecular Weight | 405.13 g/mol |
| LogP | 3.15842 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.12595 |
| Heavy Atoms | 29 |
| Complexity | 1241.904 |
Chemical Identifiers
| CAS Number | 673490-10-3 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NN=CC4=CC=CC=C43 |
Product Overview
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide (CAS 673490-10-3), with molecular formula C21H19N5O2S and molecular weight 405.13 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide.
Chemical Property Profile of N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide
Property Insights of N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide
The XLogP value of 3.15842 indicates that N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide. Following Lipinski's Rule of Five, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide has 1 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 N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide?
The CAS number of N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide is 673490-10-3.
What is the molecular formula of N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide?
The molecular formula of N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide is C21H19N5O2S.
What is the molecular weight of N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide?
The molecular weight of N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide is 405.13 g/mol.
Where can I buy N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide?
You can request a quote for N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phthalazin-1-ylsulfanylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.