N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯
TL;DR: N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 (CAS 16613-92-6) is a chemical compound with molecular formula C16H29N2O2P and molecular weight 312.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯
N-[[butyl(methyl)amino]-phenoxyphosphoryl]-N-methylbutan-1-amine
Also Known As: phenyl n,n'-dibutyl-n,n'-dimethylphosphorodiamidate, 1H-Indene,2,3,3a,4,7,7a-hexahydro, Phosphorodiamidic acid, N,N'-dibutyl-N,N'-dimethyl-, phenyl ester, N-[[butyl(methyl)amino]-phenoxyphosphoryl]-N-methylbutan-1-amine, N,N/'-Dibutyl-N,N/'-dimethyldiamidophosphoric acid phenyl ester
| Molecular Formula | C16H29N2O2P |
|---|---|
| Molecular Weight | 312.20 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 312.19666 |
| Heavy Atoms | 21 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 16613-92-6 |
|---|---|
| SMILES | CCCCN(C)P(=O)(N(C)CCCC)OC1=CC=CC=C1 |
| InChIKey | HMMSDCDWINKIDT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 (CAS 16613-92-6), with molecular formula C16H29N2O2P and molecular weight 312.20 g/mol. IUPAC: N-[[butyl(methyl)amino]-phenoxyphosphoryl]-N-methylbutan-1-amine.
Chemical Property Profile of N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯
Property Insights of N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯
The XLogP value of 4.2 indicates that N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 has 0 hydrogen bond donor(s) and 4 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 N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯?
The CAS number of N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 is 16613-92-6.
What is the molecular formula of N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯?
The molecular formula of N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 is C16H29N2O2P.
What is the molecular weight of N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯?
The molecular weight of N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 is 312.20 g/mol.
Where can I buy N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯?
You can request a quote for N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯?
Yes, KEHONG BIO provides custom synthesis services for N,N'-二丁基-N,N'-二甲基磷二酰胺酸苯酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.