CS-0435932
(3S,7S)-Benzyl 3-(((benzyloxy)carbonyl)amino)-7-methyl-2,3,4,7-tetrahydro-1H-azepine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2600792-64-9
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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
C₂₃H₂₆N₂O₄
Molecular Weight
394.46
Synonyms
None
SMILES
O=C(N1[C@@H](C)C=CC[C@H](NC(OCC2=CC=CC=C2)=O)C1)OCC3=CC=CC=C3
Tpsa
67.87
Logp
4.2686
H Acceptors
4
H Donors
1
Rotatable Bonds
5
SAFETY INFORMATION
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: C₂₃H₂₆N₂O₄
Molecular Weight: 394.46
Synonyms: None
SMILES: O=C(N1[C@@H](C)C=CC[C@H](NC(OCC2=CC=CC=C2)=O)C1)OCC3=CC=CC=C3
Tpsa: 67.87
Logp: 4.2686
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₆N₂O₄
Molecular Weight:
394.46
Synonyms:
None
SMILES:
O=C(N1[C@@H](C)C=CC[C@H](NC(OCC2=CC=CC=C2)=O)C1)OCC3=CC=CC=C3
Tpsa:
67.87
Logp:
4.2686
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆NO₄PS
Molecular Weight: 301.30
Synonyms: None
SMILES: O=P(OCC)(CC1=NC2=C(S1)C=C(O)C=C2)OCC
Tpsa: 68.65
Logp: 3.768
H Acceptors: 6
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:
C₁₂H₁₆NO₄PS
Molecular Weight:
301.30
Synonyms:
None
SMILES:
O=P(OCC)(CC1=NC2=C(S1)C=C(O)C=C2)OCC
Tpsa:
68.65
Logp:
3.768
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
6
Purity: 97%
MDL No: MFCD03844617
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₁NO₃
Molecular Weight: 263.33
Synonyms: Benzyl cis-(2-hydroxymethyl)cyclohexylcarbamate
SMILES: O=C(OCC1=CC=CC=C1)N[C@@H]2[C@@H](CCCC2)CO
Tpsa: 58.56
Logp: 2.4639
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 4
Purity:
97%
MDL No:
MFCD03844617
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₁NO₃
Molecular Weight:
263.33
Synonyms:
Benzyl cis-(2-hydroxymethyl)cyclohexylcarbamate
SMILES:
O=C(OCC1=CC=CC=C1)N[C@@H]2[C@@H](CCCC2)CO
Tpsa:
58.56
Logp:
2.4639
H Acceptors:
3
H Donors:
2
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: C₁₁H₁₆F₆N₂O₄
Molecular Weight: 354.25
Synonyms: None
SMILES: OC(C(F)(F)F)=O.N[C@@H]1CN[C@H](C=CC1)C.OC(C(F)(F)F)=O
Tpsa: 112.65
Logp: 1.5183
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₆F₆N₂O₄
Molecular Weight:
354.25
Synonyms:
None
SMILES:
OC(C(F)(F)F)=O.N[C@@H]1CN[C@H](C=CC1)C.OC(C(F)(F)F)=O
Tpsa:
112.65
Logp:
1.5183
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
0