CAS RN: 351983-31-8
5-CHLORO-2-THIOPHENECARBOXYLIC ACID HYDRAZIDE
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.20250123 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS351983-31-8
- Purity/Analytical Methods: >99.0%
351983-31-8 / 5-chlorothiophene-2-carbohydrazide
Basic Information
CAS
351983-31-8
Multi CAS
Yes
Molecular Formula
C5H5CLN2OS
Molecular Weight
176.620000
Exact Mass
175.981112
InChI
InChI=1S/C5H5ClN2OS/c6-4-2-1-3(10-4)5(9)8-7/h1-2H,7H2,(H,8,9)
InChIKey
WVOBELBQWDRLMM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
5
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
40.98
TPSA
55.12
LogP / Solubility
WLOGP
1
MLOGP
0.88
XLogP3
1.4
Consensus LogP
1.09
Log S (ESOL)
-1.87
Class (ESOL)
Soluble
Log S (Ali)
-1.73
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.76
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)
-3.08
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
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