![CAS 485394-20-5 Bis[2-((4S)-4,5-dihydro-4-isopropyloxazol-2-yl)phenyl]amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/485394-20-5.gif)
CAS RN: 485394-20-5
Bis[2-((4S)-4,5-dihydro-4-isopropyloxazol-2-yl)phenyl]amine
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-155270
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Beijing | Inquiry |
485394-20-5 / 2-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]-N-[2-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]aniline
Basic Information
CAS
485394-20-5
Multi CAS
No
Molecular Formula
C24H29N3O2
Molecular Weight
391.500000
Exact Mass
391.225977
SMILES
CC(C)[C@H]1COC(=N1)C2=CC=CC=C2NC3=CC=CC=C3C4=N[C@H](CO4)C(C)C
InChI
InChI=1S/C24H29N3O2/c1-15(2)21-13-28-23(26-21)17-9-5-7-11-19(17)25-20-12-8-6-10-18(20)24-27-22(14-29-24)16(3)4/h5-12,15-16,21-22,25H,13-14H2,1-4H3/t21-,22-/m1/s1
InChIKey
NITCFCOIRHHNRN-FGZHOGPDSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
12
Fraction Csp3
0.42
Rotatable bonds
6
H-bond acceptors
5
H-bond donors
1
Molar refractivity
118.4
TPSA
55.21
LogP / Solubility
WLOGP
5.03
MLOGP
4.45
XLogP3
5.3
Consensus LogP
4.93
Log S (ESOL)
-5.35
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.4
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.1
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.53
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4
Customers Also Viewed
-
![CAS 485394-21-6 2-[(4S)-4,5-Dihydro-4-phenyl-2-oxazolyl]-N-[2-[(4S)-4,5-dihydro-4-phenyl-2-oxazolyl]phenyl]benzenamine molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
2-[(4S)-4,5-Dihydro-4-phenyl-2-oxazolyl]-N-[2-[(4S)-4,5-dihydro-4-phenyl-2-oxazolyl]phenyl]benzenamine
- CAS RN: 485394-21-6
- Product Code: SSC-155271
-
Bis[2-((4S)-4-tert-butyl-4,5-dihydrooxazol-2-yl)phenyl]amine
- CAS RN: 485394-22-7
- Product Code: SSC-155272
-
BDP TMR NHS ester
- CAS RN: 485397-12-4
- Product Code: starshine_CAS485397-12-4
- Purity/Analytical method: >99.0%
-
1-Methyl-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine dihydrochloride
- CAS RN: 485402-35-5
- Product Code: SSC-155275
-
2-METHYL-4,5,6,7-TETRAHYDRO-3H-IMIDAZO[4,5-C]PYRIDINE DIHYDROCHLORIDE
- CAS RN: 485402-39-9
- Product Code: SSC-155276
-
![CAS 485394-21-6 2-[(4S)-4,5-Dihydro-4-phenyl-2-oxazolyl]-N-[2-[(4S)-4,5-dihydro-4-phenyl-2-oxazolyl]phenyl]benzenamine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/485394-21-6.gif)
![CAS 485394-22-7 Bis[2-((4S)-4-tert-butyl-4,5-dihydrooxazol-2-yl)phenyl]amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/485394-22-7.gif)
![CAS 485402-35-5 1-Methyl-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine dihydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/485402-35-5.gif)
![CAS 485402-39-9 2-METHYL-4,5,6,7-TETRAHYDRO-3H-IMIDAZO[4,5-C]PYRIDINE DIHYDROCHLORIDE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/485402-39-9.gif)
