CS-1001828
trans-N1-Methyl-N1-7H-pyrrolo[2,3-d]pyrimidin-4-yl-1,3-cyclobutanediamine
Manufacturer: ChemScene
CAS Number: 1622981-00-3
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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
C₁₁H₁₅N₅
Molecular Weight
217.27
Synonyms
None
SMILES
N(C)(C1=C2C(=NC=N1)NC=C2)[C@@H]3C[C@@H](N)C3
Tpsa
70.83
Logp
0.8838
H Acceptors
4
H Donors
2
Rotatable Bonds
2
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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: C₁₁H₁₅N₅
Molecular Weight: 217.27
Synonyms: None
SMILES: N(C)(C1=C2C(=NC=N1)NC=C2)[C@@H]3C[C@@H](N)C3
Tpsa: 70.83
Logp: 0.8838
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₅N₅
Molecular Weight:
217.27
Synonyms:
None
SMILES:
N(C)(C1=C2C(=NC=N1)NC=C2)[C@@H]3C[C@@H](N)C3
Tpsa:
70.83
Logp:
0.8838
H Acceptors:
4
H Donors:
2
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: C₂₀H₃₅NO₂
Molecular Weight: 321.50
Synonyms: None
SMILES: OCC(NC)(CO)CCC1=CC=C(C=C1)CCCCCCCC
Tpsa: 52.49
Logp: 3.465
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 13
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₃₅NO₂
Molecular Weight:
321.50
Synonyms:
None
SMILES:
OCC(NC)(CO)CCC1=CC=C(C=C1)CCCCCCCC
Tpsa:
52.49
Logp:
3.465
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
13
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₉NO₄
Molecular Weight: 289.33
Synonyms: None
SMILES: OC1=CC=C(C=C1O)CCNCCC2=CC=C(O)C(O)=C2
Tpsa: 92.95
Logp: 1.8838
H Acceptors: 5
H Donors: 5
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₉NO₄
Molecular Weight:
289.33
Synonyms:
None
SMILES:
OC1=CC=C(C=C1O)CCNCCC2=CC=C(O)C(O)=C2
Tpsa:
92.95
Logp:
1.8838
H Acceptors:
5
H Donors:
5
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₈F₃NO₂
Molecular Weight: 325.33
Synonyms: None
SMILES: FC(F)(F)C1=CC=C(OC(C=2C=CC=CC2)CCN(O)C)C=C1
Tpsa: 32.7
Logp: 4.5366
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₈F₃NO₂
Molecular Weight:
325.33
Synonyms:
None
SMILES:
FC(F)(F)C1=CC=C(OC(C=2C=CC=CC2)CCN(O)C)C=C1
Tpsa:
32.7
Logp:
4.5366
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
6