J2.160.182I
TL;DR: J2.160.182I (CAS 851075-79-1) is a chemical compound with molecular formula C31H34N4O2S and molecular weight 526.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-(1R,3S)-N-[2-(cyclopentanecarbonylamino)-1,3-benzothiazol-6-yl]-3-(naphthalen-2-ylmethylamino)cyclohexane-1-carboxamide
Also Known As: J2.160.182I, (1R,3S)-N-[2-(cyclopentanecarbonylamino)-1,3-benzothiazol-6-yl]-3-(2-naphthylmethylamino)cyclohexanecarboxamide, (1R,3S)-N-[2-(cyclopentanecarbonylamino)-1,3-benzothiazol-6-yl]-3-(naphthalen-2-ylmethylamino)cyclohexane-1-carboxamide, (1R)-N-[2-(Cyclopentylcarbonylamino)benzothiazole-6-yl]-3beta-[(2-naphthyl)methylamino]cyclohexane-1beta-carboxamide, (1R,3S)-N-(2-cyclopentaneamido-1,3-benzothiazol-6-yl)-3-{[(naphthalen-2-yl)methyl]amino}cyclohexane-1-carboxamide
| Molecular Formula | C31H34N4O2S |
|---|---|
| Molecular Weight | 526.24 g/mol |
| LogP | 6.8653 |
| Topological Polar Surface Area | 83.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 526.24023 |
| Heavy Atoms | 38 |
| Complexity | 1458.8313 |
Chemical Identifiers
| CAS Number | 851075-79-1 |
|---|---|
| SMILES | C1CCC(C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)[C@@H]4CCC[C@@H](C4)NCC5=CC6=CC=CC=C6C=C5 |
Product Overview
J2.160.182I (CAS 851075-79-1), with molecular formula C31H34N4O2S and molecular weight 526.24 g/mol. IUPAC: cis-(1R,3S)-N-[2-(cyclopentanecarbonylamino)-1,3-benzothiazol-6-yl]-3-(naphthalen-2-ylmethylamino)cyclohexane-1-carboxamide.
Chemical Property Profile of J2.160.182I
Property Insights of J2.160.182I
The XLogP value of 6.8653 indicates that J2.160.182I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.12 Ų falls within the moderate polarity range, balancing permeability and solubility for J2.160.182I. Following Lipinski's Rule of Five, J2.160.182I has 3 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 J2.160.182I?
The CAS number of J2.160.182I is 851075-79-1.
What is the molecular formula of J2.160.182I?
The molecular formula of J2.160.182I is C31H34N4O2S.
What is the molecular weight of J2.160.182I?
The molecular weight of J2.160.182I is 526.24 g/mol.
Where can I buy J2.160.182I?
You can request a quote for J2.160.182I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J2.160.182I?
Yes, KEHONG BIO provides custom synthesis services for J2.160.182I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.