![2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide structure](/static/products/4633/463336-13-2.webp)
2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide
TL;DR: 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide (CAS 463336-13-2) is a chemical compound with molecular formula C14H11N5O3S2 and molecular weight 361.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2,4-dioxo-1H-pyrimidin-6-yl)methylideneamino]acetamide
Also Known As: 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide, 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2,4-dioxo-1H-pyrimidin-6-yl)methylideneamino]acetamide, 2-[(1,3-Benzothiazol-2-yl)sulfanyl]-N'-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methylidene]acetohydrazide
| Molecular Formula | C14H11N5O3S2 |
|---|---|
| Molecular Weight | 361.03 g/mol |
| LogP | 0.9153 |
| Topological Polar Surface Area | 120.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.03033 |
| Heavy Atoms | 24 |
| Complexity | 959.417 |
Chemical Identifiers
| CAS Number | 463336-13-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)SCC(=O)NN=CC3=CC(=O)NC(=O)N3 |
Product Overview
2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide (CAS 463336-13-2), with molecular formula C14H11N5O3S2 and molecular weight 361.03 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2,4-dioxo-1H-pyrimidin-6-yl)methylideneamino]acetamide.
Chemical Property Profile of 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide
Property Insights of 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide
The XLogP value of 0.9153 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide. The TPSA of 120.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide. Following Lipinski's Rule of Five, 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide has 3 hydrogen bond donor(s) and 7 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 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide?
The CAS number of 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide is 463336-13-2.
What is the molecular formula of 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide?
The molecular formula of 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide is C14H11N5O3S2.
What is the molecular weight of 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide?
The molecular weight of 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide is 361.03 g/mol.
Where can I buy 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide?
You can request a quote for 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Benzothiazolylthio)acetic acid 2-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methylene]hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.