CS-0655328
(3R,4R)-N,4-Dimethyl-1-(7-((4-methylcyclohexa-1,3-dien-1-yl)sulfonyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-amine
Manufacturer: ChemScene
CAS Number: None
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₀H₂₇N₅O₂S
Molecular Weight
401.53
Synonyms
None
SMILES
O=S(N1C=CC(C1=NC=N2)=C2N3C[C@H](NC)[C@H](C)CC3)(C4=CC=C(C)CC4)=O
Tpsa
80.12
Logp
2.6674
H Acceptors
7
H Donors
1
Rotatable Bonds
4
Other Options
...
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₇N₅O₂S
Molecular Weight: 401.53
Synonyms: None
SMILES: O=S(N1C=CC(C1=NC=N2)=C2N3C[C@H](NC)[C@H](C)CC3)(C4=CC=C(C)CC4)=O
Tpsa: 80.12
Logp: 2.6674
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₇N₅O₂S
Molecular Weight:
401.53
Synonyms:
None
SMILES:
O=S(N1C=CC(C1=NC=N2)=C2N3C[C@H](NC)[C@H](C)CC3)(C4=CC=C(C)CC4)=O
Tpsa:
80.12
Logp:
2.6674
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈N₂O₃
Molecular Weight: 180.16
Synonyms: None
SMILES: O=C(OCC)C(C#N)C(CC#N)=O
Tpsa: 90.95
Logp: 0.17206
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈N₂O₃
Molecular Weight:
180.16
Synonyms:
None
SMILES:
O=C(OCC)C(C#N)C(CC#N)=O
Tpsa:
90.95
Logp:
0.17206
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₂O₆
Molecular Weight: 358.39
Synonyms: None
SMILES: CC(C)[C@]1(O2)[C@@H]2[C@@H](O3)[C@]3([C@@](CCC4=C5COC4=O)(C)[C@]5([H])C[C@H]6O7)[C@@]67C1=O
Tpsa: 80.96
Logp: 1.3113
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₂O₆
Molecular Weight:
358.39
Synonyms:
None
SMILES:
CC(C)[C@]1(O2)[C@@H]2[C@@H](O3)[C@]3([C@@](CCC4=C5COC4=O)(C)[C@]5([H])C[C@H]6O7)[C@@]67C1=O
Tpsa:
80.96
Logp:
1.3113
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇ClF₂O₂
Molecular Weight: 220.60
Synonyms: None
SMILES: ClC1=C(F)C=C(F)C(CC(OC)=O)=C1
Tpsa: 26.3
Logp: 2.3337
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇ClF₂O₂
Molecular Weight:
220.60
Synonyms:
None
SMILES:
ClC1=C(F)C=C(F)C(CC(OC)=O)=C1
Tpsa:
26.3
Logp:
2.3337
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2