(1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)-
TL;DR: (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)- (CAS 101018-78-4) is a chemical compound with molecular formula C16H17N3OS and molecular weight 299.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(piperidin-1-ylmethyl)-3H-thiochromeno[3,4-d]imidazol-4-one
Also Known As: NIOSH/DL9829860, (1)BENZOTHIOPYRANO(3,4-d)IMIDAZOL-4(1H)-ONE, 2-(1-PIPERIDINYLMETHYL)-, 2-(1-Piperidinylmethyl)(1)benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(Piperidinomethyl)(1)benzothiopyrano(3,4-d)imidazol-4(1H)-one, (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(piperidinomethyl)-
| Molecular Formula | C16H17N3OS |
|---|---|
| Molecular Weight | 299.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.10922 |
| Heavy Atoms | 21 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 101018-78-4 |
|---|---|
| SMILES | C1CCN(CC1)CC2=NC3=C(N2)C(=O)SC4=CC=CC=C43 |
| InChIKey | RLSFPRHQHCQZCQ-UHFFFAOYSA-N |
Product Overview
(1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)- (CAS 101018-78-4), with molecular formula C16H17N3OS and molecular weight 299.11 g/mol. IUPAC: 2-(piperidin-1-ylmethyl)-3H-thiochromeno[3,4-d]imidazol-4-one.
Chemical Property Profile of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)-
Property Insights of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)-. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)-. Following Lipinski's Rule of Five, (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)- has 1 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, 2-(1-piperidinylmethyl)-?
The CAS number of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)- is 101018-78-4.
What is the molecular formula of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)-?
The molecular formula of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)- is C16H17N3OS.
What is the molecular weight of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)-?
The molecular weight of (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)- is 299.11 g/mol.
Where can I buy (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)-?
You can request a quote for (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 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, 2-(1-piperidinylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for (1)Benzothiopyrano(3,4-d)imidazol-4(1H)-one, 2-(1-piperidinylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.