Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester
TL;DR: Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester (CAS 82980-46-9) is a chemical compound with molecular formula C11H16N3O3P and molecular weight 269.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1,2-benzoxazol-3-yloxy(dimethylamino)phosphoryl]-N-methylmethanamine
Also Known As: Bayer 60830, Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester, Tetramethylphosphorodiamidic acid 1,2-benzisoxazol-3-yl ester, 1,2-Benzoxazol-3-yl N,N,N',N'-tetramethylphosphorodiamidate, N-[1,2-benzoxazol-3-yloxy(dimethylamino)phosphoryl]-N-methylmethanamine
| Molecular Formula | C11H16N3O3P |
|---|---|
| Molecular Weight | 269.09 g/mol |
| LogP | 2.4379 |
| Topological Polar Surface Area | 58.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.09293 |
| Heavy Atoms | 18 |
| Complexity | 581.9859 |
Chemical Identifiers
| CAS Number | 82980-46-9 |
|---|---|
| SMILES | CN(C)P(=O)(N(C)C)OC1=NOC2=CC=CC=C21 |
Product Overview
Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester (CAS 82980-46-9), with molecular formula C11H16N3O3P and molecular weight 269.09 g/mol. IUPAC: N-[1,2-benzoxazol-3-yloxy(dimethylamino)phosphoryl]-N-methylmethanamine.
Chemical Property Profile of Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester
Property Insights of Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester
The XLogP value of 2.4379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester. With a topological polar surface area (TPSA) of 58.81 Ų, Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester 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 Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester?
The CAS number of Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester is 82980-46-9.
What is the molecular formula of Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester?
The molecular formula of Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester is C11H16N3O3P.
What is the molecular weight of Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester?
The molecular weight of Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester is 269.09 g/mol.
Where can I buy Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester?
You can request a quote for Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodiamidic acid, tetramethyl-, 1,2-benzisoxazol-3-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.