starbld0000984
TL;DR: starbld0000984 (CAS 851890-44-3) is a chemical compound with molecular formula C22H27N5O2S and molecular weight 425.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-cyanocyclohexyl)-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide
Also Known As: starbld0000984, 2-((4-Allyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(1-cyanocyclohexyl)propanamide, N-(1-cyanocyclohexyl)-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide, N-(1-cyanocyclohexyl)-2-{[5-(4-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanamide
| Molecular Formula | C22H27N5O2S |
|---|---|
| Molecular Weight | 425.19 g/mol |
| LogP | 3.96298 |
| Topological Polar Surface Area | 92.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 425.18854 |
| Heavy Atoms | 30 |
| Complexity | 925.9948 |
Chemical Identifiers
| CAS Number | 851890-44-3 |
|---|---|
| SMILES | CC(C(=O)NC1(CCCCC1)C#N)SC2=NN=C(N2CC=C)C3=CC=C(C=C3)OC |
Product Overview
starbld0000984 (CAS 851890-44-3), with molecular formula C22H27N5O2S and molecular weight 425.19 g/mol. IUPAC: N-(1-cyanocyclohexyl)-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide.
Chemical Property Profile of starbld0000984
Property Insights of starbld0000984
The XLogP value of 3.96298 indicates that starbld0000984 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.83 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0000984. Following Lipinski's Rule of Five, starbld0000984 has 1 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 starbld0000984?
The CAS number of starbld0000984 is 851890-44-3.
What is the molecular formula of starbld0000984?
The molecular formula of starbld0000984 is C22H27N5O2S.
What is the molecular weight of starbld0000984?
The molecular weight of starbld0000984 is 425.19 g/mol.
Where can I buy starbld0000984?
You can request a quote for starbld0000984 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0000984?
Yes, KEHONG BIO provides custom synthesis services for starbld0000984 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.