S33084
TL;DR: S33084 (CAS 273203-30-8) is a chemical compound with molecular formula C29H29N3O2 and molecular weight 451.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(3aR,9bS)-8-cyano-3,3a,4,9b-tetrahydro-1H-chromeno[3,4-c]pyrrol-2-yl]butyl]-4-phenylbenzamide
Also Known As: GTPL129, S-33084, PDSP2_001397, S 33084, Benzopyrano[3,4-c]pyrrole derivs, Servier
| Molecular Formula | C29H29N3O2 |
|---|---|
| Molecular Weight | 451.23 g/mol |
| LogP | 4.84328 |
| Topological Polar Surface Area | 65.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 451.22598 |
| Heavy Atoms | 34 |
| Complexity | 1184.2477 |
Chemical Identifiers
| CAS Number | 273203-30-8 |
|---|---|
| SMILES | C1[C@@H]2COC3=C([C@H]2CN1CCCCNC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)C=C(C=C3)C#N |
Product Overview
S33084 (CAS 273203-30-8), with molecular formula C29H29N3O2 and molecular weight 451.23 g/mol. IUPAC: N-[4-[(3aR,9bS)-8-cyano-3,3a,4,9b-tetrahydro-1H-chromeno[3,4-c]pyrrol-2-yl]butyl]-4-phenylbenzamide.
Chemical Property Profile of S33084
Property Insights of S33084
The XLogP value of 4.84328 indicates that S33084 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.36 Ų falls within the moderate polarity range, balancing permeability and solubility for S33084. Following Lipinski's Rule of Five, S33084 has 1 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 S33084?
The CAS number of S33084 is 273203-30-8.
What is the molecular formula of S33084?
The molecular formula of S33084 is C29H29N3O2.
What is the molecular weight of S33084?
The molecular weight of S33084 is 451.23 g/mol.
Where can I buy S33084?
You can request a quote for S33084 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S33084?
Yes, KEHONG BIO provides custom synthesis services for S33084 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.