7-苄基半胱氨酰-4-甲基香豆素酰胺
TL;DR: 7-苄基半胱氨酰-4-甲基香豆素酰胺 (CAS 80173-27-9) is a chemical compound with molecular formula C20H20N2O3S and molecular weight 368.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-苄基半胱氨酰-4-甲基香豆素酰胺
(2S)-2-amino-3-benzylsulfanyl-N-(4-methyl-2-oxochromen-7-yl)propanamide
Also Known As: H-Cys(Bzl)-AMC, BCMCA, H-L-Cys(Bzl)-AMC, 7-Benzylcysteinyl-4-methylcoumarinylamide, S-Benzyl-L-cysteine 7-amido-4-methylcoumarin
| Molecular Formula | C20H20N2O3S |
|---|---|
| Molecular Weight | 368.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 368.11948 |
| Heavy Atoms | 26 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 80173-27-9 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@@H](CSCC3=CC=CC=C3)N |
| InChIKey | WSBODWFAIQZWSU-QGZVFWFLSA-N |
Product Overview
7-苄基半胱氨酰-4-甲基香豆素酰胺 (CAS 80173-27-9), with molecular formula C20H20N2O3S and molecular weight 368.12 g/mol. IUPAC: (2S)-2-amino-3-benzylsulfanyl-N-(4-methyl-2-oxochromen-7-yl)propanamide.
Chemical Property Profile of 7-苄基半胱氨酰-4-甲基香豆素酰胺
Property Insights of 7-苄基半胱氨酰-4-甲基香豆素酰胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-苄基半胱氨酰-4-甲基香豆素酰胺. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-苄基半胱氨酰-4-甲基香豆素酰胺. Following Lipinski's Rule of Five, 7-苄基半胱氨酰-4-甲基香豆素酰胺 has 2 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 7-苄基半胱氨酰-4-甲基香豆素酰胺?
The CAS number of 7-苄基半胱氨酰-4-甲基香豆素酰胺 is 80173-27-9.
What is the molecular formula of 7-苄基半胱氨酰-4-甲基香豆素酰胺?
The molecular formula of 7-苄基半胱氨酰-4-甲基香豆素酰胺 is C20H20N2O3S.
What is the molecular weight of 7-苄基半胱氨酰-4-甲基香豆素酰胺?
The molecular weight of 7-苄基半胱氨酰-4-甲基香豆素酰胺 is 368.12 g/mol.
Where can I buy 7-苄基半胱氨酰-4-甲基香豆素酰胺?
You can request a quote for 7-苄基半胱氨酰-4-甲基香豆素酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-苄基半胱氨酰-4-甲基香豆素酰胺?
Yes, KEHONG BIO provides custom synthesis services for 7-苄基半胱氨酰-4-甲基香豆素酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.