methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate
TL;DR: methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate (CAS 63833-14-7) is a chemical compound with molecular formula C9H18N3O6PS and molecular weight 327.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate
Also Known As: Trimethyl [phosphorothioyltris(methylene)]triscarbamate, methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate, methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylme
| Molecular Formula | C9H18N3O6PS |
|---|---|
| Molecular Weight | 327.07 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 327.0654 |
| Heavy Atoms | 20 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 63833-14-7 |
|---|---|
| SMILES | COC(=O)NCP(=S)(CNC(=O)OC)CNC(=O)OC |
| InChIKey | PSEWFVZPNRLDFK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate (CAS 63833-14-7), with molecular formula C9H18N3O6PS and molecular weight 327.07 g/mol. IUPAC: methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate.
Chemical Property Profile of methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate
Property Insights of methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate. The TPSA of 147.0 Ų indicates high polarity, suggesting methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate has 3 hydrogen bond donor(s) and 7 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 methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate?
The CAS number of methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate is 63833-14-7.
What is the molecular formula of methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate?
The molecular formula of methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate is C9H18N3O6PS.
What is the molecular weight of methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate?
The molecular weight of methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate is 327.07 g/mol.
Where can I buy methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate?
You can request a quote for methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[bis[(methoxycarbonylamino)methyl]phosphinothioylmethyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.