[4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate
TL;DR: [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate (CAS 61295-75-8) is a chemical compound with molecular formula C12H15N5O5 and molecular weight 309.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate
Also Known As: [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate|[4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methy|4-(2-{[Methyl(nitroso)carbamoyl]amino}ethyl)phenyl methyl(nitroso)carbamate|Carbamic acid, n-methyl, n-nitroso-, 4[2-(n'-methyl-n'-nitroso-ureido)ethyl]phenyl ester
| Molecular Formula | C12H15N5O5 |
|---|---|
| Molecular Weight | 309.11 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.10733 |
| Heavy Atoms | 22 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 61295-75-8 |
|---|---|
| SMILES | CN(C(=O)NCCC1=CC=C(C=C1)OC(=O)N(C)N=O)N=O |
| InChIKey | LBYHODFAESFBFB-UHFFFAOYSA-N |
Product Overview
[4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate (CAS 61295-75-8), with molecular formula C12H15N5O5 and molecular weight 309.11 g/mol. IUPAC: [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate.
Chemical Property Profile of [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate
Property Insights of [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate. Following Lipinski's Rule of Five, [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate has 1 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 [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate?
The CAS number of [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate is 61295-75-8.
What is the molecular formula of [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate?
The molecular formula of [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate is C12H15N5O5.
What is the molecular weight of [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate?
The molecular weight of [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate is 309.11 g/mol.
Where can I buy [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate?
You can request a quote for [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate?
Yes, KEHONG BIO provides custom synthesis services for [4-[2-[[methyl(nitroso)carbamoyl]amino]ethyl]phenyl] N-methyl-N-nitrosocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.