CAS RN: 90196-39-7
1-Benzimidazolecarboxaldehyde (7CI)
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.20250816 | 5g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS90196-39-7
- Purity/Analytical Methods: >99.0%
90196-39-7 / benzimidazole-1-carbaldehyde
Basic Information
CAS
90196-39-7
Multi CAS
No
Molecular Formula
C8H6N2O
Molecular Weight
146.150000
Exact Mass
146.048013
InChI
InChI=1S/C8H6N2O/c11-6-10-5-9-7-3-1-2-4-8(7)10/h1-6H
InChIKey
OVLBRKILZDEOMU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
41.88
TPSA
34.89
LogP / Solubility
WLOGP
1.07
MLOGP
0.94
XLogP3
1.3
Consensus LogP
1.1
Log S (ESOL)
-1.96
Class (ESOL)
Soluble
Log S (Ali)
-1.53
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.62
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
2-Cyanoquinuclidine
- CAS RN: 90196-91-1
- Product Code: starshine_CAS90196-91-1
- Purity/Analytical method: >99.0%
-
3-(4,4-DIMETHYL-2,5-DIOXOIMIDAZOLIDIN-1-YL)PROPANOIC ACID HYDRATE
- CAS RN: 90197-83-4
- Product Code: SSC-202677
-
dimethyl-N,N’-oxalamidodiethanoate
- CAS RN: 90197-99-2
- Product Code: starshine_CAS90197-99-2
- Purity/Analytical method: >99.0%
-
Cyclobutane-1,3-dicarboxylicaciddiMethylester
- CAS RN: 90199-98-7
- Product Code: SSC-202680
-
