N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide
TL;DR: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide (CAS 868674-35-5) is a chemical compound with molecular formula C14H14N2O2S and molecular weight 274.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide
Also Known As: F1816-0952, N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide, N-[(2Z)-4-methoxy-3-(prop-2-yn-1-yl)-2,3-dihydro-1,3-benzothiazol-2-ylidene]propanamide, (Z)-N-(4-methoxy-3-(prop-2-yn-1-yl)benzo[d]thiazol-2(3H)-ylidene)propionamide, 1-[(Z)-4-methoxy-3-(2-propynyl)-2,3-dihydro-1,3-benzothiazol-2-ylideneamino]-1-propanone
| Molecular Formula | C14H14N2O2S |
|---|---|
| Molecular Weight | 274.08 g/mol |
| LogP | 2.1819 |
| Topological Polar Surface Area | 43.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.0776 |
| Heavy Atoms | 19 |
| Complexity | 719.1017 |
Chemical Identifiers
| CAS Number | 868674-35-5 |
|---|---|
| SMILES | CCC(=O)N=C1N(C2=C(C=CC=C2S1)OC)CC#C |
Product Overview
N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide (CAS 868674-35-5), with molecular formula C14H14N2O2S and molecular weight 274.08 g/mol. IUPAC: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide.
Chemical Property Profile of N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide
Property Insights of N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide
The XLogP value of 2.1819 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide. With a topological polar surface area (TPSA) of 43.59 Ų, N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide has 0 hydrogen bond donor(s) and 3 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 N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide?
The CAS number of N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide is 868674-35-5.
What is the molecular formula of N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide?
The molecular formula of N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide is C14H14N2O2S.
What is the molecular weight of N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide?
The molecular weight of N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide is 274.08 g/mol.
Where can I buy N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide?
You can request a quote for N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.