半胱天冬酶抑制剂I
TL;DR: 半胱天冬酶抑制剂I (CAS 143313-51-3) is a chemical compound with molecular formula C23H32N4O8 and molecular weight 492.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
半胱天冬酶抑制剂I
3-[2-[[2-[[2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]propanoylamino]-4-oxobutanoic acid
Also Known As: Caspase Inhibitor I, Ycad-CHO, YVAD-CHO, Caspase-1 Inhibitor I, Acetyl-tyr-val-ala-asp-cho
| Molecular Formula | C23H32N4O8 |
|---|---|
| Molecular Weight | 492.22 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 492.22202 |
| Heavy Atoms | 35 |
| Complexity | 779.0 |
Chemical Identifiers
| CAS Number | 143313-51-3 |
|---|---|
| SMILES | CC(C)C(C(=O)NC(C)C(=O)NC(CC(=O)O)C=O)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C |
| InChIKey | LPIARALSGDVZEP-UHFFFAOYSA-N |
Product Overview
半胱天冬酶抑制剂I (CAS 143313-51-3), with molecular formula C23H32N4O8 and molecular weight 492.22 g/mol. IUPAC: 3-[2-[[2-[[2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]propanoylamino]-4-oxobutanoic acid.
Chemical Property Profile of 半胱天冬酶抑制剂I
Property Insights of 半胱天冬酶抑制剂I
The XLogP value of -0.8 indicates that 半胱天冬酶抑制剂I is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 191.0 Ų indicates high polarity, suggesting 半胱天冬酶抑制剂I may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 半胱天冬酶抑制剂I has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 半胱天冬酶抑制剂I?
The CAS number of 半胱天冬酶抑制剂I is 143313-51-3.
What is the molecular formula of 半胱天冬酶抑制剂I?
The molecular formula of 半胱天冬酶抑制剂I is C23H32N4O8.
What is the molecular weight of 半胱天冬酶抑制剂I?
The molecular weight of 半胱天冬酶抑制剂I is 492.22 g/mol.
Where can I buy 半胱天冬酶抑制剂I?
You can request a quote for 半胱天冬酶抑制剂I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 半胱天冬酶抑制剂I?
Yes, KEHONG BIO provides custom synthesis services for 半胱天冬酶抑制剂I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.