CAS RN: 1217694-15-9
(2S)-2-(3-BROMOPHENYL)PYRROLIDINE
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.20260524 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-024481
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 | Hong Kong | Inquiry |
1217694-15-9 / (2S)-2-(3-bromophenyl)pyrrolidine
Basic Information
CAS
1217694-15-9
Multi CAS
No
Molecular Formula
C10H12BrN
Molecular Weight
226.110000
Exact Mass
225.015310
SMILES
C1C[C@H](NC1)C2=CC(=CC=C2)Br
InChI
InChI=1S/C10H12BrN/c11-9-4-1-3-8(7-9)10-5-2-6-12-10/h1,3-4,7,10,12H,2,5-6H2/t10-/m0/s1
InChIKey
FIRVFEHVSIYTIO-JTQLQIEISA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
54.12
TPSA
12.03
LogP / Solubility
WLOGP
2.87
MLOGP
2.53
XLogP3
2.5
Consensus LogP
2.63
Log S (ESOL)
-3.36
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.49
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.63
Class (SILICOS-IT)
Poorly 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)
-2.06
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
Morpholine, 3-(chloroMethyl)-4-(phenylMethyl)-, (3R)-
- CAS RN: 1217697-39-6
- Product Code: starshine_CAS1217697-39-6
- Purity/Analytical method: >99.0%
-
-
-
FMoc-(R)-3-aMino-2-(hydroxyMethyl)propanoic acid
- CAS RN: 1217699-77-8
- Product Code: SSC-024484
-
(R)-3-aMino-2-(hydroxyMethyl)propanoic acid
- CAS RN: 1217700-75-8
- Product Code: starshine_CAS1217700-75-8
- Purity/Analytical method: >99.0%
-
S-3-(AMINOMETHYL)-1-N-BOC-PIPERIDINE-HCl
- CAS RN: 1217702-57-2
- Product Code: starshine_CAS1217702-57-2
- Purity/Analytical method: >99.0%
