![[[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea structure](/static/products/369/369605-89-0.png)
[[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea
TL;DR: [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea (CAS 369605-89-0) is a chemical compound with molecular formula C12H13ClN4O2S and molecular weight 312.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(2-chloroethyl)-2-hydroxy-5-methoxyindol-3-yl]iminothiourea
Also Known As: [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea|[(E)-[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea|[(Z)-[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea|(E)-2-(1-(2-chloroethyl)-5-methoxy-2-oxoindolin-3-ylidene)hydrazinecarbothioamide|(2E)-2-[1-(2-chloroethyl)-5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinecarbothioamide
| Molecular Formula | C12H13ClN4O2S |
|---|---|
| Molecular Weight | 312.04 g/mol |
| LogP | 2.9216 |
| Topological Polar Surface Area | 85.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.04477 |
| Heavy Atoms | 20 |
| Complexity | 683.63745 |
Chemical Identifiers
| CAS Number | 369605-89-0 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N(C(=C2N=NC(=S)N)O)CCCl |
Product Overview
[[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea (CAS 369605-89-0), with molecular formula C12H13ClN4O2S and molecular weight 312.04 g/mol. IUPAC: [1-(2-chloroethyl)-2-hydroxy-5-methoxyindol-3-yl]iminothiourea.
Chemical Property Profile of [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea
Property Insights of [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea
The XLogP value of 2.9216 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea. The TPSA of 85.13 Ų falls within the moderate polarity range, balancing permeability and solubility for [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea. Following Lipinski's Rule of Five, [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea 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
Frequently Asked Questions
What is the CAS number of [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea?
The CAS number of [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea is 369605-89-0.
What is the molecular formula of [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea?
The molecular formula of [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea is C12H13ClN4O2S.
What is the molecular weight of [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea?
The molecular weight of [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea is 312.04 g/mol.
Where can I buy [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea?
You can request a quote for [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [[1-(2-chloroethyl)-5-methoxy-2-oxoindol-3-ylidene]amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.