(1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)-
TL;DR: (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)- (CAS 101018-80-8) is a chemical compound with molecular formula C20H25N3OS and molecular weight 355.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-2-(piperidin-1-ylmethyl)thiochromeno[3,4-d]imidazol-4-one
Also Known As: hydrochloride, NIOSH/DL9829660, (1)BENZOTHIOPYRANO(3,4-d)IMIDAZOL-4(1H)-ONE, 1-BUTYL-2-(1-PIPERIDINYLMETHYL)-, 1-Butyl-2-(1-piperidinylmethyl)(1)benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(piperidin-1-ylmethyl)thiochromeno[3,4-d]imidazol-4-one
| Molecular Formula | C20H25N3OS |
|---|---|
| Molecular Weight | 355.17 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 355.17184 |
| Heavy Atoms | 25 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 101018-80-8 |
|---|---|
| SMILES | CCCCN1C(=NC2=C1C3=CC=CC=C3SC2=O)CN4CCCCC4 |
| InChIKey | APKDNAHEMGOTMQ-UHFFFAOYSA-N |
Product Overview
(1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)- (CAS 101018-80-8), with molecular formula C20H25N3OS and molecular weight 355.17 g/mol. IUPAC: 1-butyl-2-(piperidin-1-ylmethyl)thiochromeno[3,4-d]imidazol-4-one.
Chemical Property Profile of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)-
Property Insights of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)-
The XLogP value of 3.9 indicates that (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)-. Following Lipinski's Rule of Five, (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)- has 0 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)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)-?
The CAS number of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)- is 101018-80-8.
What is the molecular formula of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)-?
The molecular formula of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)- is C20H25N3OS.
What is the molecular weight of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)-?
The molecular weight of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)- is 355.17 g/mol.
Where can I buy (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)-?
You can request a quote for (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 1-butyl-2-(1-piperidinylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.