CAS RN: 178422-40-7
(Z)-2-(2-Aminothiazol-4-yl)-N-(2,2-dihydroxyethyl)-2-(hydroxyimino)acetamide
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.20260122 | 5mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS178422-40-7
- Purity/Analytical Methods: >99.0%
178422-40-7 / (2Z)-2-(2-amino-1,3-thiazol-4-yl)-N-(2,2-dihydroxyethyl)-2-hydroxyiminoacetamide
Basic Information
CAS
178422-40-7
Multi CAS
No
Molecular Formula
C7H10N4O4S
Molecular Weight
246.250000
Exact Mass
246.042276
SMILES
C1=C(N=C(S1)N)/C(=N/O)/C(=O)NCC(O)O
InChI
InChI=1S/C7H10N4O4S/c8-7-10-3(2-16-7)5(11-15)6(14)9-1-4(12)13/h2,4,12-13,15H,1H2,(H2,8,10)(H,9,14)/b11-5-
InChIKey
VRXTXNVEOQTWAG-WZUFQYTHSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
5
Fraction Csp3
0.29
Rotatable bonds
4
H-bond acceptors
8
H-bond donors
5
Molar refractivity
56.09
TPSA
141.06
LogP / Solubility
WLOGP
-1.67
MLOGP
-1.46
XLogP3
-0.3
Consensus LogP
-1.14
Log S (ESOL)
-0.28
Class (ESOL)
Very soluble
Log S (Ali)
-0.37
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.35
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.41
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 178422-42-9 Cefdinir Related Compound A (10 mg) (2(R)-2-[(Z)-2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido]-2-[(2RS,5RS)-5-methyl-7-oxo-2,4,5,7-tetrahydro-1Hfuro[3,4-d][1,3]thiazin-2-yl]acetic acid) molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
Cefdinir Related Compound A (10 mg) (2(R)-2-[(Z)-2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido]-2-[(2RS,5RS)-5-methyl-7-oxo-2,4,5,7-tetrahydro-1Hfuro[3,4-d][1,3]thiazin-2-yl]acetic acid)
- CAS RN: 178422-42-9
- Product Code: starshine_CAS178422-42-9
- Purity/Analytical method: >99.0%
-
“1-tert-butyl 4-ethyl 3-hydroxy-1H-pyrazole-1,4-dicarboxylate”
- CAS RN: 178424-17-4
- Product Code: SSC-079056
-
-
-
(βR)-β-amino-Benzenepropanol 1-carbamate hydrochloride (1:1)
- CAS RN: 178429-65-7
- Product Code: SSC-079073
-
2-(N,N-Dimethylsulphamoyl)phenylboronic acid
- CAS RN: 178432-25-2
- Product Code: SSC-079091
![CAS 178422-42-9 Cefdinir Related Compound A (10 mg) (2(R)-2-[(Z)-2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido]-2-[(2RS,5RS)-5-methyl-7-oxo-2,4,5,7-tetrahydro-1Hfuro[3,4-d][1,3]thiazin-2-yl]acetic acid) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/178422-42-9.gif)
