RefChem:315464
TL;DR: RefChem:315464 (CAS 1101-58-2) is a chemical compound with molecular formula C16H18N4O6 and molecular weight 362.12262 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-acetamido-6-amino-3-hydroxy-7-methyl-5,8-dioxo-2,3-dihydro-1H-pyrrolo[1,2-a]indol-4-yl)methyl carbamate
Also Known As: KST-1A0551, [2-(acetylamino)-7-amino-1-hydroxy-6-methyl-5,8-dioxo-2,3,5,8-tetrahydro-1h-pyrrolo[1,2-a]indol-9-yl]methyl carbamate, Acetamide, N-(7-amino-5,8-dioxo-1-hydroxy-9-(hydroxymethyl)-6-methyl-2,3,5,8-tetrahydro-1H-pyrrolo(1,2-a)indol-2-yl)-, 9-carbamate, Acetamide,N-(7-amino-5,8-dioxo-1-hydroxy-9-(hydroxymethyl)-6-methyl-2,3,5,8-tetrahydro-1H-pyrrolo[1,2-a]indol-2-yl)-,9-carbamate, N-(7-Amino-1-hydroxy-9-{[hydroxy(imino)methoxy]methyl}-6-methyl-5,8-dioxo-2,3,5,8-tetrahydro-1H-pyrrolo[1,2-a]indol-2-yl)ethanimidic acid
Technical Specifications
| Molecular Formula | C16H18N4O6 |
| Molecular Weight | 362.12262 g/mol |
| XLogP | -2.2 |
| Topological Polar Surface Area (TPSA) | 167.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.12262 Da |
| Heavy Atoms | 26 |
| Complexity | 720.0 |
| SMILES | CC1=C(C(=O)C2=C(C1=O)N3CC(C(C3=C2COC(=O)N)O)NC(=O)C)N |
| InChIKey | HFJJKGOJLPDATE-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:315464
Property Insights of RefChem:315464
The XLogP value of -2.2 indicates that RefChem:315464 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 167.0 Ų indicates high polarity, suggesting RefChem:315464 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:315464 has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:315464?
The CAS number of RefChem:315464 is 1101-58-2.
What is the molecular formula of RefChem:315464?
The molecular formula of RefChem:315464 is C16H18N4O6.
What is the molecular weight of RefChem:315464?
The molecular weight of RefChem:315464 is 362.12262 g/mol.
Where can I buy RefChem:315464?
You can request a quote for RefChem:315464 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:315464?
Yes, CoreyChem provides custom synthesis services for RefChem:315464 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.