UPCMLD0ENAT5863182:001
TL;DR: UPCMLD0ENAT5863182:001 (CAS 313400-75-8) is a chemical compound with molecular formula C19H26N4O2S and molecular weight 374.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone
Also Known As: UPCMLD0ENAT5863182:001, 2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone, 2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethanone, 2-((5-(4-(tert-butyl)phenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-1-morpholinoethanone, 4-(([5-(4-tert-Butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl)acetyl)morpholine #
| Molecular Formula | C19H26N4O2S |
|---|---|
| Molecular Weight | 374.18 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 85.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.17764 |
| Heavy Atoms | 26 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 313400-75-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)N3CCOCC3 |
| InChIKey | KMCKPRMPSMMCRV-UHFFFAOYSA-N |
Product Overview
UPCMLD0ENAT5863182:001 (CAS 313400-75-8), with molecular formula C19H26N4O2S and molecular weight 374.18 g/mol. IUPAC: 2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone.
Chemical Property Profile of UPCMLD0ENAT5863182:001
Property Insights of UPCMLD0ENAT5863182:001
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5863182:001. The TPSA of 85.6 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5863182:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5863182:001 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 UPCMLD0ENAT5863182:001?
The CAS number of UPCMLD0ENAT5863182:001 is 313400-75-8.
What is the molecular formula of UPCMLD0ENAT5863182:001?
The molecular formula of UPCMLD0ENAT5863182:001 is C19H26N4O2S.
What is the molecular weight of UPCMLD0ENAT5863182:001?
The molecular weight of UPCMLD0ENAT5863182:001 is 374.18 g/mol.
Where can I buy UPCMLD0ENAT5863182:001?
You can request a quote for UPCMLD0ENAT5863182:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5863182:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5863182:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.