propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3
TL;DR: propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3 (CAS 76990-28-8) is a chemical compound with molecular formula C12H18N3O3P and molecular weight 283.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3λ5-benzodiazaphosphepin-3-yl)carbamate
Also Known As: propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3, propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3lambda5-benzodiazaph, propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3lambda5-benzodiazaphosphepin-3-yl)carbamate, Propan-2-yl (3-oxo-2,3,4,5-tetrahydro-1H-2,4,3lambda~5~-benzodiazaphosphepin-3-yl)carbamate
| Molecular Formula | C12H18N3O3P |
|---|---|
| Molecular Weight | 283.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.10858 |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 76990-28-8 |
|---|---|
| SMILES | CC(C)OC(=O)NP1(=O)NCC2=CC=CC=C2CN1 |
| InChIKey | FXCWRRIVPGQXQM-UHFFFAOYSA-N |
Product Overview
propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3 (CAS 76990-28-8), with molecular formula C12H18N3O3P and molecular weight 283.11 g/mol. IUPAC: propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3λ5-benzodiazaphosphepin-3-yl)carbamate.
Chemical Property Profile of propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3
Property Insights of propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3. Following Lipinski's Rule of Five, propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3 has 3 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 propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3?
The CAS number of propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3 is 76990-28-8.
What is the molecular formula of propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3?
The molecular formula of propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3 is C12H18N3O3P.
What is the molecular weight of propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3?
The molecular weight of propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3 is 283.11 g/mol.
Where can I buy propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3?
You can request a quote for propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3?
Yes, KEHONG BIO provides custom synthesis services for propan-2-yl N-(3-oxo-1,2,4,5-tetrahydro-2,4,3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.