Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester
TL;DR: Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester (CAS 37532-29-9) is a chemical compound with molecular formula C22H28N2O4S and molecular weight 416.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-propan-2-ylphenyl) N-[[(3-propan-2-ylphenoxy)carbonylamino]methylsulfanylmethyl]carbamate
Also Known As: Bismip sulfide, 3-Isopropylphenylbicarbamoylsulfid, Thiobis(methylcarbamic acid) bis(3-(1-methylethyl)phenyl) ester, CARBAMIC ACID, THIOBIS(METHYL-, BIS(3-(1-METHYLETHYL)PHENYL) ESTER, Bis(3-isopropylphenyl) [sulfanediylbis(methylene)]biscarbamate
| Molecular Formula | C22H28N2O4S |
|---|---|
| Molecular Weight | 416.18 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 416.17697 |
| Heavy Atoms | 29 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 37532-29-9 |
|---|---|
| SMILES | CC(C)C1=CC(=CC=C1)OC(=O)NCSCNC(=O)OC2=CC=CC(=C2)C(C)C |
| InChIKey | BPJIOAVCTUZJKK-UHFFFAOYSA-N |
Product Overview
Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester (CAS 37532-29-9), with molecular formula C22H28N2O4S and molecular weight 416.18 g/mol. IUPAC: (3-propan-2-ylphenyl) N-[[(3-propan-2-ylphenoxy)carbonylamino]methylsulfanylmethyl]carbamate.
Chemical Property Profile of Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester
Property Insights of Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester
The XLogP value of 5.9 indicates that Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester. Following Lipinski's Rule of Five, Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester?
The CAS number of Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester is 37532-29-9.
What is the molecular formula of Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester?
The molecular formula of Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester is C22H28N2O4S.
What is the molecular weight of Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester?
The molecular weight of Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester is 416.18 g/mol.
Where can I buy Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester?
You can request a quote for Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, thiobis(methyl-, bis(3-(1-methylethyl)phenyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.