![CAS 2375281-44-8 Benzoic acid, 3-[2-[(2-fluorophenyl)amino]-5-oxazolyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2375281-44-8.gif)
CAS RN: 2375281-44-8
Benzoic acid, 3-[2-[(2-fluorophenyl)amino]-5-oxazolyl]-
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
- Product code: starshine_CAS2375281-44-8
- Purity/Analytical Methods: >99.0%
2375281-44-8 / 3-[2-(2-fluoroanilino)-1,3-oxazol-5-yl]benzoic acid
Basic Information
CAS
2375281-44-8
Multi CAS
No
Molecular Formula
C16H11FN2O3
Molecular Weight
298.270000
Exact Mass
298.075370
SMILES
C1=CC=C(C(=C1)NC2=NC=C(O2)C3=CC(=CC=C3)C(=O)O)F
InChI
InChI=1S/C16H11FN2O3/c17-12-6-1-2-7-13(12)19-16-18-9-14(22-16)10-4-3-5-11(8-10)15(20)21/h1-9H,(H,18,19)(H,20,21)
InChIKey
VGJMPWREFUKMAD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
17
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
2
Molar refractivity
78.58
TPSA
75.36
LogP / Solubility
WLOGP
3.92
MLOGP
3.46
XLogP3
3.5
Consensus LogP
3.63
Log S (ESOL)
-4.47
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.84
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.33
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.75
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
-
1-Piperazinecarboxylic acid, 5-(hydroxymethyl)-2-methyl-, 1,1-dimethylethyl ester, (2R,5S)-
- CAS RN: 2375423-99-5
- Product Code: SSC-115493
-
1-Piperazinecarboxylic acid, 5-(hydroxymethyl)-2-methyl-, 1,1-dimethylethyl ester, (2S,5S)-
- CAS RN: 2375424-00-1
- Product Code: SSC-115494
-
Quinoline, 2-[(4R)-4-(1,1-dimethylethyl)-4,5-dihydro-2-oxazolyl]-5,6,7,8-tetrahydro-
- CAS RN: 2375437-25-3
- Product Code: starshine_CAS2375437-25-3
- Purity/Analytical method: >99.0%
-
(S)-5-hydroxy-3-(2-(((1-((1-methyl-1H-imidazol-4-yl)methyl)-1H-indol-6-yl)methylamino)methyl)-1H-indol-3-yl)isoindolin-1-one
- CAS RN: 2375482-51-0
- Product Code: SSC-115499
-
tert-butyl 2-(4-isopropoxybenzamido)-6,7-dihydrothiazolo[5,4-c]pyridine-5(4H)-carboxylate
- CAS RN: 2375541-45-8
- Product Code: starshine_CAS2375541-45-8
- Purity/Analytical method: >99.0%
![CAS 2375437-25-3 Quinoline, 2-[(4R)-4-(1,1-dimethylethyl)-4,5-dihydro-2-oxazolyl]-5,6,7,8-tetrahydro- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2375437-25-3.gif)
![CAS 2375541-45-8 tert-butyl 2-(4-isopropoxybenzamido)-6,7-dihydrothiazolo[5,4-c]pyridine-5(4H)-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2375541-45-8.gif)