CAS RN: 75785-12-5
7-methy-5-nitro-1H-indazole
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.20260330 | 100mg | Out of stock | 1 business days | Inquiry |
- Product code: starshine_CAS75785-12-5
- Purity/Analytical Methods: >99.0%
75785-12-5 / 7-methyl-5-nitro-1H-indazole
Basic Information
CAS
75785-12-5
Multi CAS
No
Molecular Formula
C8H7N3O2
Molecular Weight
177.160000
Exact Mass
177.053826
InChI
InChI=1S/C8H7N3O2/c1-5-2-7(11(12)13)3-6-4-9-10-8(5)6/h2-4H,1H3,(H,9,10)
InChIKey
JOJIHKJWRAFXSC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
47.49
TPSA
71.82
LogP / Solubility
WLOGP
1.78
MLOGP
1.56
XLogP3
1.7
Consensus LogP
1.68
Log S (ESOL)
-2.51
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.3
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.41
Class (SILICOS-IT)
Moderately 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)
-2.54
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
-
H-TYR-GLY-GLY-PHE-LEU-ARG-ARG-ILE-OH
- CAS RN: 75790-53-3
- Product Code: starshine_CAS75790-53-3
- Purity/Analytical method: >99.0%
-
3-chloro-6-(2-methyl-1H-imidazol-1-yl)pyridazine(SALTDATA: FREE)
- CAS RN: 75792-66-4
- Product Code: SSC-185220
-
-
Presapogenin CP4
- CAS RN: 75799-18-7
- Product Code: starshine_CAS75799-18-7
- Purity/Analytical method: >99.0%
-
-
