UPCMLD0ENAT5603776:001
TL;DR: UPCMLD0ENAT5603776:001 (CAS 384802-49-7) is a chemical compound with molecular formula C18H19BrN2O4S and molecular weight 438.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-bromophenyl)-3-(2,3-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
Also Known As: UPCMLD0ENAT5603776:001, F1138-0043, 3-(4-bromophenyl)-5-(2,3-dimethoxyphenyl)-1-methanesulfonyl-4,5-dihydro-1H-pyrazole, 3-(4-bromophenyl)-5-(2,3-dimethoxyphenyl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazole, 5-(4-bromophenyl)-3-(2,3-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
| Molecular Formula | C18H19BrN2O4S |
|---|---|
| Molecular Weight | 438.02 g/mol |
| LogP | 3.577 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.0249 |
| Heavy Atoms | 26 |
| Complexity | 942.1635 |
Chemical Identifiers
| CAS Number | 384802-49-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C2CC(=NN2S(=O)(=O)C)C3=CC=C(C=C3)Br |
Product Overview
UPCMLD0ENAT5603776:001 (CAS 384802-49-7), with molecular formula C18H19BrN2O4S and molecular weight 438.02 g/mol. IUPAC: 5-(4-bromophenyl)-3-(2,3-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole.
Chemical Property Profile of UPCMLD0ENAT5603776:001
Property Insights of UPCMLD0ENAT5603776:001
The XLogP value of 3.577 indicates that UPCMLD0ENAT5603776:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5603776:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5603776:001 has 0 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 UPCMLD0ENAT5603776:001?
The CAS number of UPCMLD0ENAT5603776:001 is 384802-49-7.
What is the molecular formula of UPCMLD0ENAT5603776:001?
The molecular formula of UPCMLD0ENAT5603776:001 is C18H19BrN2O4S.
What is the molecular weight of UPCMLD0ENAT5603776:001?
The molecular weight of UPCMLD0ENAT5603776:001 is 438.02 g/mol.
Where can I buy UPCMLD0ENAT5603776:001?
You can request a quote for UPCMLD0ENAT5603776:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5603776:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5603776:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.