BAS 01507023
TL;DR: BAS 01507023 (CAS 333435-38-4) is a chemical compound with molecular formula C18H17ClN2O2S and molecular weight 360.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Also Known As: BAS 01507023, 2-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile, 2-(5-chloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile, 2-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydro-1H-isoindol-2(3H)-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
| Molecular Formula | C18H17ClN2O2S |
|---|---|
| Molecular Weight | 360.07 g/mol |
| LogP | 3.91078 |
| Topological Polar Surface Area | 61.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 360.06992 |
| Heavy Atoms | 24 |
| Complexity | 804.67615 |
Chemical Identifiers
| CAS Number | 333435-38-4 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC(=C2C#N)N3C(=O)C4CC=C(CC4C3=O)Cl |
Product Overview
BAS 01507023 (CAS 333435-38-4), with molecular formula C18H17ClN2O2S and molecular weight 360.07 g/mol. IUPAC: 2-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile.
Chemical Property Profile of BAS 01507023
Property Insights of BAS 01507023
The XLogP value of 3.91078 indicates that BAS 01507023 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01507023. Following Lipinski's Rule of Five, BAS 01507023 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 BAS 01507023?
The CAS number of BAS 01507023 is 333435-38-4.
What is the molecular formula of BAS 01507023?
The molecular formula of BAS 01507023 is C18H17ClN2O2S.
What is the molecular weight of BAS 01507023?
The molecular weight of BAS 01507023 is 360.07 g/mol.
Where can I buy BAS 01507023?
You can request a quote for BAS 01507023 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01507023?
Yes, KEHONG BIO provides custom synthesis services for BAS 01507023 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.