![(E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide structure](/static/products/370/370575-65-8.png)
(E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
TL;DR: (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide (CAS 370575-65-8) is a chemical compound with molecular formula C23H27N3O4S2 and molecular weight 473.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Also Known As: (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide, 2-({[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide, 2-[({[3-(3,4-DIMETHOXYPHENYL)ACRYLOYL]AMINO}CARBOTHIOYL)AMINO]-4,5,6,7,8,9-HEXAHYDROCYCLOOCTA[B]THIOPHENE-3-CARBOXAMIDE, 2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
| Molecular Formula | C23H27N3O4S2 |
|---|---|
| Molecular Weight | 473.14 g/mol |
| LogP | 4.0496 |
| Topological Polar Surface Area | 102.68 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 473.1443 |
| Heavy Atoms | 32 |
| Complexity | 1046.1028 |
Chemical Identifiers
| CAS Number | 370575-65-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C/C(=O)NC(=S)NC2=C(C3=C(S2)CCCCCC3)C(=O)N)OC |
Product Overview
(E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide (CAS 370575-65-8), with molecular formula C23H27N3O4S2 and molecular weight 473.14 g/mol. IUPAC: 2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide.
Chemical Property Profile of (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Property Insights of (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
The XLogP value of 4.0496 indicates that (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide. Following Lipinski's Rule of Five, (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide has 3 hydrogen bond donor(s) and 6 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 (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide?
The CAS number of (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide is 370575-65-8.
What is the molecular formula of (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide?
The molecular formula of (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide is C23H27N3O4S2.
What is the molecular weight of (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide?
The molecular weight of (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide is 473.14 g/mol.
Where can I buy (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide?
You can request a quote for (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(3-(3-(3,4-dimethoxyphenyl)acryloyl)thioureido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.