C24H30N4O4S
TL;DR: C24H30N4O4S (CAS 957028-83-0) is a chemical compound with molecular formula C24H30N4O4S and molecular weight 470.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,9S)-N-[(2S)-1-(4-methoxyanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
Also Known As: (1R,5R)-N-((S)-1-((4-methoxyphenyl)amino)-4-(methylthio)-1-oxobutan-2-yl)-8-oxo-4,5,6,8-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(2H)-carboxamide, (1S,5S)-N-[(2S)-1-[(4-methoxyphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
| Molecular Formula | C24H30N4O4S |
|---|---|
| Molecular Weight | 470.20 g/mol |
| LogP | 2.746 |
| Topological Polar Surface Area | 92.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 470.1988 |
| Heavy Atoms | 33 |
| Complexity | 1055.1749 |
Chemical Identifiers
| CAS Number | 957028-83-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)N2C[C@H]3C[C@@H](C2)C4=CC=CC(=O)N4C3 |
Product Overview
C24H30N4O4S (CAS 957028-83-0), with molecular formula C24H30N4O4S and molecular weight 470.20 g/mol. IUPAC: (1S,9S)-N-[(2S)-1-(4-methoxyanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide.
Chemical Property Profile of C24H30N4O4S
Property Insights of C24H30N4O4S
The XLogP value of 2.746 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C24H30N4O4S. The TPSA of 92.67 Ų falls within the moderate polarity range, balancing permeability and solubility for C24H30N4O4S. Following Lipinski's Rule of Five, C24H30N4O4S 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 C24H30N4O4S?
The CAS number of C24H30N4O4S is 957028-83-0.
What is the molecular formula of C24H30N4O4S?
The molecular formula of C24H30N4O4S is C24H30N4O4S.
What is the molecular weight of C24H30N4O4S?
The molecular weight of C24H30N4O4S is 470.20 g/mol.
Where can I buy C24H30N4O4S?
You can request a quote for C24H30N4O4S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C24H30N4O4S?
Yes, KEHONG BIO provides custom synthesis services for C24H30N4O4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.