UPCMLD0ENAT5603782:001
TL;DR: UPCMLD0ENAT5603782:001 (CAS 498568-56-2) is a chemical compound with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3-dimethoxyphenyl)-5-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
Also Known As: UPCMLD0ENAT5603782:001, 5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazole, F1138-0042, 5-(2,3-dimethoxyphenyl)-1-methanesulfonyl-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole, 3-(2,3-dimethoxyphenyl)-5-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole
| Molecular Formula | C19H22N2O5S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 2.8231 |
| Topological Polar Surface Area | 77.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.12494 |
| Heavy Atoms | 27 |
| Complexity | 954.56537 |
Chemical Identifiers
| CAS Number | 498568-56-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN(C(C2)C3=C(C(=CC=C3)OC)OC)S(=O)(=O)C |
Product Overview
UPCMLD0ENAT5603782:001 (CAS 498568-56-2), with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol. IUPAC: 3-(2,3-dimethoxyphenyl)-5-(4-methoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole.
Chemical Property Profile of UPCMLD0ENAT5603782:001
Property Insights of UPCMLD0ENAT5603782:001
The XLogP value of 2.8231 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5603782:001. The TPSA of 77.43 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5603782:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5603782:001 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 UPCMLD0ENAT5603782:001?
The CAS number of UPCMLD0ENAT5603782:001 is 498568-56-2.
What is the molecular formula of UPCMLD0ENAT5603782:001?
The molecular formula of UPCMLD0ENAT5603782:001 is C19H22N2O5S.
What is the molecular weight of UPCMLD0ENAT5603782:001?
The molecular weight of UPCMLD0ENAT5603782:001 is 390.12 g/mol.
Where can I buy UPCMLD0ENAT5603782:001?
You can request a quote for UPCMLD0ENAT5603782:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5603782:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5603782:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.