SCAEG
TL;DR: SCAEG (CAS 119733-44-7) is a chemical compound with molecular formula C24H25Cl2NO8 and molecular weight 525.0957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
舍曲林氨基甲酰-O-葡萄糖醛酸
6-[[(1S,4S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]-methylcarbamoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: SCAEG, Sertraline carbamoyl-O-glucuronide, Sertraline carbamic acid ester glucuronide, 6-[[(1S,4S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]-methylcarbamoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid, 1-o-{[(1s,4s)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl](methyl)carbamoyl}hexopyranuronic acid
Technical Specifications
| Molecular Formula | C24H25Cl2NO8 |
| Molecular Weight | 525.0957 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 137.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 525.0957 Da |
| Heavy Atoms | 35 |
| Complexity | 774.0 |
| SMILES | CN([C@H]1CC[C@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl)C(=O)OC4C(C(C(C(O4)C(=O)O)O)O)O |
| InChIKey | IFPBIAXQORQOIY-FQAKDOLHSA-N |
Chemical Property Profile of SCAEG
Property Insights of SCAEG
The XLogP value of 3.2 indicates that SCAEG is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for SCAEG. Following Lipinski's Rule of Five, SCAEG has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of SCAEG?
The CAS number of SCAEG is 119733-44-7.
What is the molecular formula of SCAEG?
The molecular formula of SCAEG is C24H25Cl2NO8.
What is the molecular weight of SCAEG?
The molecular weight of SCAEG is 525.0957 g/mol.
Where can I buy SCAEG?
You can request a quote for SCAEG directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for SCAEG?
Yes, CoreyChem provides custom synthesis services for SCAEG and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.