3H-Indole, hydrazinecarbothioamide deriv.
TL;DR: 3H-Indole, hydrazinecarbothioamide deriv. (CAS 58430-91-4) is a chemical compound with molecular formula C15H18N4O6S and molecular weight 382.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]indol-3-yl]iminothiourea
Also Known As: 3H-Indole, hydrazinecarbothioamide deriv., Hydrazinecarbothioamide,2-dihydro-2-oxo-3H-indol-3-ylidene)-, Hydrazinecarbothioamide,2-dihydro-2-oxo-3H-indol-3-ylidine)-, (3Z)-3-(2-Carbamothioylhydrazinylidene)-1-hexopyranosyl-1,3-dihydro-2H-indol-2-one, [[2-oxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]indol-3-ylidene]amino]thiourea
| Molecular Formula | C15H18N4O6S |
|---|---|
| Molecular Weight | 382.09 g/mol |
| LogP | -0.3534 |
| Topological Polar Surface Area | 166.05 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.0947 |
| Heavy Atoms | 26 |
| Complexity | 854.01935 |
Chemical Identifiers
| CAS Number | 58430-91-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(N2C3C(C(C(C(O3)CO)O)O)O)O)N=NC(=S)N |
Product Overview
3H-Indole, hydrazinecarbothioamide deriv. (CAS 58430-91-4), with molecular formula C15H18N4O6S and molecular weight 382.09 g/mol. IUPAC: [2-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]indol-3-yl]iminothiourea.
Chemical Property Profile of 3H-Indole, hydrazinecarbothioamide deriv.
Property Insights of 3H-Indole, hydrazinecarbothioamide deriv.
The XLogP value of -0.3534 indicates that 3H-Indole, hydrazinecarbothioamide deriv. is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 166.05 Ų indicates high polarity, suggesting 3H-Indole, hydrazinecarbothioamide deriv. may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3H-Indole, hydrazinecarbothioamide deriv. has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3H-Indole, hydrazinecarbothioamide deriv.?
The CAS number of 3H-Indole, hydrazinecarbothioamide deriv. is 58430-91-4.
What is the molecular formula of 3H-Indole, hydrazinecarbothioamide deriv.?
The molecular formula of 3H-Indole, hydrazinecarbothioamide deriv. is C15H18N4O6S.
What is the molecular weight of 3H-Indole, hydrazinecarbothioamide deriv.?
The molecular weight of 3H-Indole, hydrazinecarbothioamide deriv. is 382.09 g/mol.
Where can I buy 3H-Indole, hydrazinecarbothioamide deriv.?
You can request a quote for 3H-Indole, hydrazinecarbothioamide deriv. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Indole, hydrazinecarbothioamide deriv.?
Yes, KEHONG BIO provides custom synthesis services for 3H-Indole, hydrazinecarbothioamide deriv. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.