CAS RN: 78706-11-3
1H-Benzimidazole,2-(5-methyl-2-furanyl)-(9CI)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260519 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS78706-11-3
- Purity/Analytical Methods: >99.0%
78706-11-3 / 2-(5-methylfuran-2-yl)-1H-benzimidazole
Basic Information
CAS
78706-11-3
Multi CAS
No
Molecular Formula
C12H10N2O
Molecular Weight
198.220000
Exact Mass
198.079313
InChI
InChI=1S/C12H10N2O/c1-8-6-7-11(15-8)12-13-9-4-2-3-5-10(9)14-12/h2-7H,1H3,(H,13,14)
InChIKey
BLIMSOPINYXOID-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
14
Fraction Csp3
0.08
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
58.53
TPSA
41.82
LogP / Solubility
WLOGP
3.13
MLOGP
2.76
XLogP3
2.6
Consensus LogP
2.83
Log S (ESOL)
-3.67
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.45
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.67
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.71
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 78706-26-0 5,7-DICHLORO-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
5,7-DICHLORO-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE
- CAS RN: 78706-26-0
- Product Code: SSC-188046
-
plantagoside
- CAS RN: 78708-33-5
- Product Code: starshine_CAS78708-33-5
- Purity/Analytical method: >99.0%
-
2-FLUORO-L-TYROSINE
- CAS RN: 78709-81-6
- Product Code: starshine_CAS78709-81-6
- Purity/Analytical method: >99.0%
-
2-CHLORO-N-(2-METHYLBENZYL)ACETAMIDE
- CAS RN: 78710-36-8
- Product Code: starshine_CAS78710-36-8
- Purity/Analytical method: >99.0%
-
-
![CAS 78706-26-0 5,7-DICHLORO-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/78706-26-0.gif)
