KNI 272; Kynostatin; NSC 651714
TL;DR: KNI 272; Kynostatin; NSC 651714 (CAS 147318-81-8) is a chemical compound with molecular formula C33H41N5O6S2 and molecular weight 667.2498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide
N-tert-butyl-3-[2-hydroxy-3-[[2-[(2-isoquinolin-5-yloxyacetyl)amino]-3-methylsulfanylpropanoyl]amino]-4-phenylbutanoyl]-1,3-thiazolidine-4-carboxamide
Also Known As: Kynostatin 272, Kynostatin 272 [MeSH], KNI 272; Kynostatin; NSC 651714, 3-[3-benzyl-2-hydroxy-9-(isoquinolin-5-yloxy)-6-methylsulfanylmethyl-5,8-dioxo-4,7-diazanonanoyl]-N-t-butyl-1,3-thiazolidine-4-carboxamide, N-tert-butyl-3-[2-hydroxy-3-[[2-[(2-isoquinolin-5-yloxyacetyl)amino]-3-methylsulfanylpropanoyl]amino]-4-phenylbutanoyl]-1,3-thiazolidine-4-carboxamide
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C33H41N5O6S2 |
| Molecular Weight | 667.2498 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 201.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 14 |
| Exact Mass | 667.2498 Da |
| Heavy Atoms | 46 |
| Complexity | 1040.0 |
| SMILES | CC(C)(C)NC(=O)C1CSCN1C(=O)C(C(CC2=CC=CC=C2)NC(=O)C(CSC)NC(=O)COC3=CC=CC4=C3C=CN=C4)O |
| InChIKey | NJBBLOIWMSYVCQ-UHFFFAOYSA-N |
Chemical Property Profile of KNI 272; Kynostatin; NSC 651714
Property Insights of KNI 272; Kynostatin; NSC 651714
The XLogP value of 3.2 indicates that KNI 272; Kynostatin; NSC 651714 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 201.0 Ų indicates high polarity, suggesting KNI 272; Kynostatin; NSC 651714 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, KNI 272; Kynostatin; NSC 651714 has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of KNI 272; Kynostatin; NSC 651714?
The CAS number of KNI 272; Kynostatin; NSC 651714 is 147318-81-8.
What is the molecular formula of KNI 272; Kynostatin; NSC 651714?
The molecular formula of KNI 272; Kynostatin; NSC 651714 is C33H41N5O6S2.
What is the molecular weight of KNI 272; Kynostatin; NSC 651714?
The molecular weight of KNI 272; Kynostatin; NSC 651714 is 667.2498 g/mol.
Where can I buy KNI 272; Kynostatin; NSC 651714?
You can request a quote for KNI 272; Kynostatin; NSC 651714 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for KNI 272; Kynostatin; NSC 651714?
Yes, CoreyChem provides custom synthesis services for KNI 272; Kynostatin; NSC 651714 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.