![N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide structure](/static/products/134/134328-41-9.webp)
N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide
TL;DR: N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide (CAS 134328-41-9) is a chemical compound with molecular formula C14H17N3O2S and molecular weight 291.10416 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-(1,3-benzothiazol-2-yl)-N-propylbutanediamide
Also Known As: N'-(1,3-benzothiazol-2-yl)-N-propylbutanediamide, N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide
Technical Specifications
| Molecular Formula | C14H17N3O2S |
| Molecular Weight | 291.10416 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 99.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 291.10416 Da |
| Heavy Atoms | 20 |
| Complexity | 351.0 |
| SMILES | CCCNC(=O)CCC(=O)NC1=NC2=CC=CC=C2S1 |
| InChIKey | LMQKJINKQGJIFN-UHFFFAOYSA-N |
Chemical Property Profile of N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide
Property Insights of N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide. The TPSA of 99.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide. Following Lipinski's Rule of Five, N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide?
The CAS number of N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide is 134328-41-9.
What is the molecular formula of N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide?
The molecular formula of N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide is C14H17N3O2S.
What is the molecular weight of N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide?
The molecular weight of N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide is 291.10416 g/mol.
Where can I buy N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide?
You can request a quote for N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide?
Yes, CoreyChem provides custom synthesis services for N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-N'-propylbutanediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.