![3-Iminobenzo[f]chromene-2-carbothioamide structure](/static/products/971/97145-96-5.png)
3-Iminobenzo[f]chromene-2-carbothioamide
TL;DR: 3-Iminobenzo[f]chromene-2-carbothioamide (CAS 97145-96-5) is a chemical compound with molecular formula C14H10N2OS and molecular weight 254.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iminobenzo[f]chromene-2-carbothioamide
Also Known As: 3-iminobenzo[f]chromene-2-carbothioamide, 3-Imino-3H-benzo[f]chromene-2-carbothioamide, 3-imino-2-benzo[f][1]benzopyrancarbothioamide, 3H-Naphtho[2,1-b]pyran-2-carbothioamide, 3-imino-, 3-Imino-3H-naphtho[2,1-b]pyran-2-carbothioamide
| Molecular Formula | C14H10N2OS |
|---|---|
| Molecular Weight | 254.05 g/mol |
| LogP | 2.69967 |
| Topological Polar Surface Area | 63.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.05139 |
| Heavy Atoms | 18 |
| Complexity | 835.9316 |
Chemical Identifiers
| CAS Number | 97145-96-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=C(C(=N)O3)C(=S)N |
Product Overview
3-Iminobenzo[f]chromene-2-carbothioamide (CAS 97145-96-5), with molecular formula C14H10N2OS and molecular weight 254.05 g/mol. IUPAC: 3-iminobenzo[f]chromene-2-carbothioamide.
Chemical Property Profile of 3-Iminobenzo[f]chromene-2-carbothioamide
Property Insights of 3-Iminobenzo[f]chromene-2-carbothioamide
The XLogP value of 2.69967 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Iminobenzo[f]chromene-2-carbothioamide. The TPSA of 63.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Iminobenzo[f]chromene-2-carbothioamide. Following Lipinski's Rule of Five, 3-Iminobenzo[f]chromene-2-carbothioamide has 2 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 3-Iminobenzo[f]chromene-2-carbothioamide?
The CAS number of 3-Iminobenzo[f]chromene-2-carbothioamide is 97145-96-5.
What is the molecular formula of 3-Iminobenzo[f]chromene-2-carbothioamide?
The molecular formula of 3-Iminobenzo[f]chromene-2-carbothioamide is C14H10N2OS.
What is the molecular weight of 3-Iminobenzo[f]chromene-2-carbothioamide?
The molecular weight of 3-Iminobenzo[f]chromene-2-carbothioamide is 254.05 g/mol.
Where can I buy 3-Iminobenzo[f]chromene-2-carbothioamide?
You can request a quote for 3-Iminobenzo[f]chromene-2-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Iminobenzo[f]chromene-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Iminobenzo[f]chromene-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.