BAS 02999441
TL;DR: BAS 02999441 (CAS 375831-88-2) is a chemical compound with molecular formula C20H21N3O5S and molecular weight 415.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[3-(dimethylsulfamoyl)-4-methylphenyl]-1-oxophthalazin-2-yl]acetate
Also Known As: BAS 02999441, methyl {4-[3-(dimethylsulfamoyl)-4-methylphenyl]-1-oxophthalazin-2(1H)-yl}acetate, methyl 2-(4-(3-(N,N-dimethylsulfamoyl)-4-methylphenyl)-1-oxophthalazin-2(1H)-yl)acetate, METHYL 2-{4-[3-(DIMETHYLSULFAMOYL)-4-METHYLPHENYL]-1-OXOPHTHALAZIN-2-YL}ACETATE
| Molecular Formula | C20H21N3O5S |
|---|---|
| Molecular Weight | 415.12 g/mol |
| LogP | 1.79522 |
| Topological Polar Surface Area | 98.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 415.12018 |
| Heavy Atoms | 29 |
| Complexity | 1262.837 |
Chemical Identifiers
| CAS Number | 375831-88-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)OC)S(=O)(=O)N(C)C |
Product Overview
BAS 02999441 (CAS 375831-88-2), with molecular formula C20H21N3O5S and molecular weight 415.12 g/mol. IUPAC: methyl 2-[4-[3-(dimethylsulfamoyl)-4-methylphenyl]-1-oxophthalazin-2-yl]acetate.
Chemical Property Profile of BAS 02999441
Property Insights of BAS 02999441
The XLogP value of 1.79522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02999441. The TPSA of 98.57 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02999441. Following Lipinski's Rule of Five, BAS 02999441 has 0 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 BAS 02999441?
The CAS number of BAS 02999441 is 375831-88-2.
What is the molecular formula of BAS 02999441?
The molecular formula of BAS 02999441 is C20H21N3O5S.
What is the molecular weight of BAS 02999441?
The molecular weight of BAS 02999441 is 415.12 g/mol.
Where can I buy BAS 02999441?
You can request a quote for BAS 02999441 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02999441?
Yes, KEHONG BIO provides custom synthesis services for BAS 02999441 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.