[email protected]
CAS 212312-33-9 (3aR,8aS)-2-[2-(diphenylphosphino)phenyl]-3a,8a-dihydro-8H-Indeno[1,2-d]oxazole molecular structure lightbox
CAS RN: 212312-33-9

(3aR,8aS)-2-[2-(diphenylphosphino)phenyl]-3a,8a-dihydro-8H-Indeno[1,2-d]oxazole

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260628 100mg In stock Inquiry
Batchno.20260123 1g In stock Inquiry
Batchno.20250822 250mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251129 100mg In stock Shanghai Inquiry
Batchno.20250723 1g In stock Shanghai, Tianjin Inquiry
Batchno.20251122 250mg In stock Shanghai Inquiry
Batchno.20250614 50mg In stock Shanghai, Chengdu Inquiry
  • Product code: SSC-101426
GET A QUOTE
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
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 212312-33-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

212312-33-9 / [2-[(3aS,8bR)-4,8b-dihydro-3aH-indeno[1,2-d][1,3]oxazol-2-yl]phenyl]-diphenylphosphane

Standard CAS: 212312-33-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
212312-33-9
Multi CAS
No
Molecular Formula
C28H22NOP
Molecular Weight
419.500000
Exact Mass
419.143901
SMILES
C1[C@H]2[C@@H](C3=CC=CC=C31)N=C(O2)C4=CC=CC=C4P(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C28H22NOP/c1-3-12-21(13-4-1)31(22-14-5-2-6-15-22)26-18-10-9-17-24(26)28-29-27-23-16-8-7-11-20(23)19-25(27)30-28/h1-18,25,27H,19H2/t25-,27+/m0/s1
InChIKey
QOXFUKATAROLOT-AHKZPQOWSA-N

Computed Properties

Structural Parameters

Heavy atom count
31
Aromatic heavy atom count
24
Fraction Csp3
0.11
Rotatable bonds
4
H-bond acceptors
2
Molar refractivity
129.44
TPSA
21.59

LogP / Solubility

WLOGP
4.89
MLOGP
4.33
XLogP3
5.9
Consensus LogP
5.04
Log S (ESOL)
-5.83
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.53
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.92
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)
-1.81

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

Customers Also Viewed

Get In Touch

Contact Us